OV - Compare Functions

Functions

Name	Module	Coverage (%)	Time (s)	Nb Threads	Deviation (coverage)	Deviation (time)
Name	Module	gcc	aocc	aocc-libalm	icx	gcc	aocc	aocc-libalm	icx	gcc	aocc	aocc-libalm	icx	gcc	aocc	aocc-libalm	icx	gcc	aocc	aocc-libalm	icx
void gmx::nbnxmKernelSimd<(KernelLayout)1, (gmx::KernelCoulombType)1, (VdwCutoffCheck)0, (LJCombinationRule)1, (InteractionModifiers)1, (LJEwald)0, (EnergyOutput)0>(NbnxnPairlistCpu const, nbnxn_atomdata_t const, interaction_const_t const*, float c...	libgromacs_mpi.so.9.0.0	21.36	18.98	18.93	23.55	2.86	2.95	3.02	2.92	128	128	128	128	2.49	2.23	2.29	2.88	0.33	0.35	0.36	0.35
ADIOI_GEN_SetLockDirect64	libmpi.so.12.0.0	17.60	15.02	15.48	18.49	2.36	2.34	2.47	2.30	192	192	192	192	9.11	7.59	7.60	9.47	1.20	1.17	1.20	1.16
MPIDI_SHMGR_Gather	libmpi.so.12.0.0	7.47	9.72	9.65	7.03	1.00	1.51	1.54	0.87	192	192	192	192	5.99	7.19	6.78	4.76	0.79	1.11	1.07	0.58
energyDriftAtomPair(bool, bool, float, float, float, float, pot_derivatives_t const*)	libgromacs_mpi.so.9.0.0	NA	9.08	9.68	9.00	NA	1.41	1.54	1.12	NA	192	192	192	NA	2.07	2.20	2.23	NA	0.32	0.35	0.28
f64xsubf128	libm.so.6	9.30	11.02	3.34	NA	1.25	1.72	0.53	NA	192	192	192	NA	2.35	2.65	0.90	NA	0.31	0.41	0.14	NA
erfcf	libm.so.6	5.81	7.92	7.49	NA	0.78	1.23	1.19	NA	192	192	192	NA	1.49	1.90	1.77	NA	0.20	0.29	0.28	NA
void gmx::nbnxmKernelSimd<(KernelLayout)1, (gmx::KernelCoulombType)1, (VdwCutoffCheck)0, (LJCombinationRule)1, (InteractionModifiers)1, (LJEwald)0, (EnergyOutput)1>(NbnxnPairlistCpu const, nbnxn_atomdata_t const, interaction_const_t const*, float c...	libgromacs_mpi.so.9.0.0	3.65	3.34	3.35	4.07	0.49	0.52	0.53	0.51	128	128	128	128	0.56	0.50	0.44	0.55	0.07	0.08	0.07	0.07
MPIR_Progress_hook_exec_on_vci	libmpi.so.12.0.0	3.29	2.74	2.98	3.39	0.44	0.43	0.48	0.42	192	192	192	192	1.93	1.37	1.53	1.70	0.25	0.21	0.24	0.21
energyDrift(gmx::ArrayRef<VerletbufAtomtype const>, gmx_ffparams_t const*, float, pot_derivatives_t const&, pot_derivatives_t const&, pot_derivatives_t const&, float, float, float, int, float)	libgromacs_mpi.so.9.0.0	1.70	3.28	3.36	2.44	0.23	0.51	0.53	0.30	192	192	192	192	0.47	0.78	0.82	0.64	0.06	0.12	0.13	0.08
energyDriftAtomPair(bool, bool, float, float, float, float, pot_derivatives_t const*) [clone .isra.0]	libgromacs_mpi.so.9.0.0	7.76	NA	NA	NA	1.04	NA	NA	NA	192	NA	NA	NA	1.87	NA	NA	NA	0.25	NA	NA	NA
MPID_Progress_wait	libmpi.so.12.0.0	1.68	1.44	1.54	1.73	0.23	0.22	0.24	0.21	192	192	192	192	0.84	0.71	0.74	0.83	0.11	0.11	0.12	0.10
gather_f_bsplines(gmx_pme_t const, float const, bool, PmeAtomComm const, splinedata_t const, float)	libgromacs_mpi.so.9.0.0	1.61	1.30	1.28	1.50	0.22	0.20	0.20	0.19	64	64	64	64	0.76	0.59	0.53	0.73	0.10	0.09	0.08	0.09
fft5d_execute(fft5d_plan_t, int, gmx_wallcycle)	libgromacs_mpi.so.9.0.0	0.75	1.29	1.31	1.79	0.10	0.20	0.21	0.22	64	64	64	64	0.32	0.38	0.38	0.43	0.04	0.06	0.06	0.05
__libm_exp_z0	binary	NA	NA	NA	4.49	NA	NA	NA	0.56	NA	NA	NA	192	NA	NA	NA	1.13	NA	NA	NA	0.14
amd_exp_zn4	libalm.so	NA	NA	4.47	NA	NA	NA	0.71	NA	NA	NA	192	NA	NA	NA	1.06	NA	NA	NA	0.17	NA
impi_shm_heap_progress	libmpi.so.12.0.0	0.98	0.86	0.94	1.06	0.13	0.13	0.15	0.13	192	192	192	192	0.53	0.46	0.48	0.54	0.07	0.07	0.08	0.07
amd_expf_zn4	libalm.so	NA	NA	3.22	NA	NA	NA	0.51	NA	NA	NA	192	NA	NA	NA	0.80	NA	NA	NA	0.13	NA
__libm_erfcf_l9	binary	NA	NA	NA	3.08	NA	NA	NA	0.38	NA	NA	NA	192	NA	NA	NA	0.77	NA	NA	NA	0.10
MPIDI_SHMI_progress	libmpi.so.12.0.0	0.63	0.56	0.59	0.68	0.08	0.09	0.09	0.08	192	192	192	192	0.34	0.30	0.31	0.34	0.05	0.05	0.05	0.04
__libm_expf_l9	binary	NA	NA	NA	2.34	NA	NA	NA	0.29	NA	NA	NA	192	NA	NA	NA	0.62	NA	NA	NA	0.08
.omp_outlined..2	libgromacs_mpi.so.9.0.0	NA	1.16	1.15	NA	NA	0.18	0.18	NA	NA	64	64	NA	NA	0.49	0.53	NA	NA	0.08	0.08	NA
exp	libm.so.6	1.11	0.93	NA	NA	0.15	0.14	NA	NA	192	192	NA	NA	0.32	0.28	NA	NA	0.04	0.04	NA	NA
void nbnxmSimdPruneKernel<(KernelLayout)1>(NbnxnPairlistCpu*, nbnxn_atomdata_t const&, gmx::ArrayRef<gmx::BasicVector<float> const>, float)	libgromacs_mpi.so.9.0.0	0.88	0.37	0.37	0.40	0.12	0.06	0.06	0.05	128	128	128	128	0.27	0.12	0.14	0.16	0.04	0.02	0.02	0.02
I_MPI_memcpy_multipage_sse	libmpi.so.12.0.0	0.50	0.43	0.42	0.54	0.07	0.07	0.07	0.07	127	128	125	128	0.58	0.53	0.52	0.66	0.08	0.08	0.08	0.08
gmx::lincs_matrix_expand(gmx::Lincs const&, (anonymous namespace)::Task const&, gmx::ArrayRef<float const>, gmx::ArrayRef<float>, gmx::ArrayRef<float>, gmx::ArrayRef<float>)	libgromacs_mpi.so.9.0.0	NA	0.53	0.53	0.68	NA	0.08	0.08	0.08	NA	117	116	114	NA	0.58	0.60	0.74	NA	0.09	0.09	0.09
spread_on_grid(gmx_pme_t const, PmeAtomComm, pmegrids_t const, bool, bool, float, bool, int) [clone .extracted.11]	libgromacs_mpi.so.9.0.0	NA	NA	NA	1.43	NA	NA	NA	0.18	NA	NA	NA	64	NA	NA	NA	0.67	NA	NA	NA	0.08
spread_on_grid(gmx_pme_t const, PmeAtomComm, pmegrids_t const, bool, bool, float, bool, int) [clone ._omp_fn.1]	libgromacs_mpi.so.9.0.0	1.38	NA	NA	NA	0.18	NA	NA	NA	64	NA	NA	NA	0.61	NA	NA	NA	0.08	NA	NA	NA
std::enable_if<((BondedKernelFlavor)0)==((BondedKernelFlavor)0), float>::type (anonymous namespace)::pdihs<(BondedKernelFlavor)0>(int, int const, t_iparams const, float const () [3], float () [4], float () [3], t_pbc const, float, float*,...	libgromacs_mpi.so.9.0.0	0.27	0.33	0.33	0.40	0.04	0.05	0.05	0.05	102	108	106	108	0.42	0.46	0.47	0.58	0.05	0.07	0.07	0.07
MPID_Progress_completion_count_get	libmpi.so.12.0.0	0.33	0.27	0.29	0.34	0.04	0.04	0.05	0.04	191	192	191	192	0.20	0.16	0.17	0.19	0.03	0.02	0.03	0.02
solve_pme_yzx(gmx_pme_t const, t_complex, float, bool, int, int)	libgromacs_mpi.so.9.0.0	0.29	0.31	0.30	0.25	0.04	0.05	0.05	0.03	64	64	64	64	0.19	0.16	0.16	0.17	0.03	0.03	0.03	0.02
PairlistSet::constructPairlists(gmx::InteractionLocality, Nbnxm::GridSet const&, gmx::ArrayRef<PairsearchWork>, nbnxn_atomdata_t, gmx::ListOfLists<int> const&, int, t_nrnb, SearchCycleCounting*) [clone .extracted.68]	libgromacs_mpi.so.9.0.0	NA	NA	NA	1.12	NA	NA	NA	0.14	NA	NA	NA	128	NA	NA	NA	0.17	NA	NA	NA	0.02
mkl_dft_def_ownscDftFwd_Prime8_32fc	libmkl_def.so.2	0.29	0.25	0.25	0.32	0.04	0.04	0.04	0.04	64	64	64	64	0.17	0.16	0.16	0.22	0.02	0.02	0.03	0.03
std::enable_if<((BondedKernelFlavor)0)==((BondedKernelFlavor)0), float>::type (anonymous namespace)::angles<(BondedKernelFlavor)0>(int, int const, t_iparams const, float const () [3], float () [4], float () [3], t_pbc const, float, float*...	libgromacs_mpi.so.9.0.0	0.30	0.25	0.24	0.31	0.04	0.04	0.04	0.04	111	107	112	110	0.36	0.30	0.28	0.37	0.05	0.05	0.04	0.05
mkl_dft_def_ownscDftInv_Prime8_32fc	libmkl_def.so.2	0.29	0.25	0.24	0.31	0.04	0.04	0.04	0.04	64	64	64	64	0.20	0.16	0.15	0.15	0.03	0.02	0.02	0.02
copy_rvec_to_nbat_real(int const, int, int, float const () [3], int, float*, int)	libgromacs_mpi.so.9.0.0	0.25	0.25	0.25	0.32	0.03	0.04	0.04	0.04	128	128	128	128	0.12	0.11	0.10	0.13	0.02	0.02	0.02	0.02
void nbnxn_make_pairlist_part<NbnxnPairlistCpu>(Nbnxm::GridSet const&, Nbnxm::Grid const&, Nbnxm::Grid const&, PairsearchWork, nbnxn_atomdata_t const, gmx::ListOfLists<int> const&, float, PairlistType, int, bool, int, bool, fl...	libgromacs_mpi.so.9.0.0	1.00	NA	NA	NA	0.13	NA	NA	NA	128	NA	NA	NA	0.16	NA	NA	NA	0.02	NA	NA	NA
gmx::csettle(gmx::SettleData const&, int, int, t_pbc const*, gmx::ArrayRefWithPadding<gmx::BasicVector<float> const>, gmx::ArrayRefWithPadding<gmx::BasicVector<float> >, float, gmx::ArrayRefWithPadding<gmx::BasicVector<flo...	libgromacs_mpi.so.9.0.0	0.00	0.30	0.29	0.37	0.00	0.05	0.05	0.05	15	128	128	127	0.01	0.19	0.20	0.27	0.00	0.03	0.03	0.03
.omp_outlined..37	libgromacs_mpi.so.9.0.0	NA	0.48	0.46	NA	NA	0.08	0.07	NA	NA	118	117	NA	NA	0.53	0.49	NA	NA	0.08	0.08	NA
.omp_outlined..9#0x65dd70	libgromacs_mpi.so.9.0.0	NA	0.91	NA	NA	NA	0.14	NA	NA	NA	128	NA	NA	NA	0.16	NA	NA	NA	0.02	NA	NA
.omp_outlined..9#0x65e110	libgromacs_mpi.so.9.0.0	NA	NA	0.90	NA	NA	NA	0.14	NA	NA	NA	128	NA	NA	NA	0.15	NA	NA	NA	0.02	NA
gmx::lincs_update_atoms(gmx::Lincs, int, float, gmx::ArrayRef<float const>, gmx::ArrayRef<gmx::BasicVector<float> const>, gmx::ArrayRef<float const>, float () [3])	libgromacs_mpi.so.9.0.0	0.23	0.20	0.20	0.26	0.03	0.03	0.03	0.03	113	113	109	112	0.26	0.22	0.21	0.28	0.03	0.03	0.03	0.03
dd_move_f(gmx_domdec_t, gmx::ForceWithShiftForces, gmx_wallcycle*)	libgromacs_mpi.so.9.0.0	0.20	0.22	0.22	0.21	0.03	0.03	0.03	0.03	128	128	128	128	0.12	0.11	0.10	0.11	0.02	0.02	0.02	0.01
do_redist_pos_coeffs(gmx_pme_t, t_commrec const, bool, gmx::ArrayRef<gmx::BasicVector<float> const>, gmx::ArrayRef<float const>)	libgromacs_mpi.so.9.0.0	0.24	0.18	0.19	0.23	0.03	0.03	0.03	0.03	64	64	64	64	0.21	0.15	0.16	0.19	0.03	0.02	0.03	0.02
mkl_dft_def_owns_cRadix4FwdNorm_32fc	libmkl_def.so.2	0.22	0.19	0.19	0.24	0.03	0.03	0.03	0.03	64	64	64	64	0.16	0.15	0.13	0.18	0.02	0.02	0.02	0.02
do_pairs(int, int, int const, t_iparams const, float const () [3], float () [4], float () [3], t_pbc const, float const, float, gmx::ArrayRef<float const>, gmx::ArrayRef<float const>, gmx::ArrayRef<bool const>, gmx::ArrayRef<un...	libgromacs_mpi.so.9.0.0	0.24	0.26	0.27	0.02	0.03	0.04	0.04	0.00	108	106	110	63	0.33	0.36	0.37	0.05	0.04	0.06	0.06	0.01
mkl_dft_def_owns_cRadix4InvNorm_32fc	libmkl_def.so.2	0.22	0.17	0.18	0.23	0.03	0.03	0.03	0.03	64	64	64	64	0.14	0.11	0.13	0.14	0.02	0.02	0.02	0.02
gmx::lincs_matrix_expand(gmx::Lincs const&, (anonymous namespace)::Task const&, gmx::ArrayRef<float const>, gmx::ArrayRef<float>, gmx::ArrayRef<float>, gmx::ArrayRef<float>) [clone .isra.0]	libgromacs_mpi.so.9.0.0	0.79	NA	NA	NA	0.11	NA	NA	NA	119	NA	NA	NA	0.86	NA	NA	NA	0.11	NA	NA	NA
MPIDIG_send_origin_cb	libmpi.so.12.0.0	0.20	0.17	0.17	0.22	0.03	0.03	0.03	0.03	188	189	189	190	0.10	0.09	0.08	0.12	0.01	0.01	0.01	0.01
dd_pmeredist_f(gmx_pme_t, PmeAtomComm, gmx::ArrayRef<gmx::BasicVector<float> >, bool)	libgromacs_mpi.so.9.0.0	0.19	0.15	0.14	0.20	0.03	0.02	0.02	0.02	64	64	64	64	0.15	0.13	0.14	0.17	0.02	0.02	0.02	0.02
I_MPI_memcpy_sse	libmpi.so.12.0.0	0.18	0.16	0.15	0.19	0.02	0.02	0.02	0.02	191	189	183	187	0.11	0.09	0.10	0.12	0.02	0.01	0.02	0.01
mkl_dft_def_ownscDftInv_Fact3_32fc	libmkl_def.so.2	0.17	0.14	0.14	0.17	0.02	0.02	0.02	0.02	64	64	64	64	0.15	0.12	0.12	0.15	0.02	0.02	0.02	0.02
gmx::do_lincs(gmx::ArrayRefWithPadding<gmx::BasicVector<float> const>, gmx::ArrayRefWithPadding<gmx::BasicVector<float> >, float const () [3], t_pbc, gmx::Lincs, int, gmx::ArrayRef<float const>, t_commrec const, bool, floa...	libgromacs_mpi.so.9.0.0	NA	NA	NA	0.62	NA	NA	NA	0.08	NA	NA	NA	119	NA	NA	NA	0.70	NA	NA	NA	0.09
mkl_dft_def_ownscDftFwd_Fact3_32fc	libmkl_def.so.2	0.16	0.14	0.14	0.18	0.02	0.02	0.02	0.02	64	64	64	64	0.16	0.11	0.11	0.14	0.02	0.02	0.02	0.02
gmx::do_lincs(gmx::ArrayRefWithPadding<gmx::BasicVector<float> const>, gmx::ArrayRefWithPadding<gmx::BasicVector<float> >, float const () [3], t_pbc, gmx::Lincs, int, gmx::ArrayRef<float const>, t_commrec const, bool, floa...	libgromacs_mpi.so.9.0.0	0.48	NA	NA	NA	0.06	NA	NA	NA	118	NA	NA	NA	0.52	NA	NA	NA	0.07	NA	NA	NA
dd_move_x(gmx_domdec_t, float const () [3], gmx::ArrayRef<gmx::BasicVector<float> >, gmx_wallcycle*)	libgromacs_mpi.so.9.0.0	0.12	0.12	0.11	0.13	0.02	0.02	0.02	0.02	127	128	128	127	0.08	0.09	0.08	0.08	0.01	0.01	0.01	0.01
.omp_outlined..28	libgromacs_mpi.so.9.0.0	NA	0.22	0.24	NA	NA	0.03	0.04	NA	NA	128	128	NA	NA	0.11	0.10	NA	NA	0.02	0.02	NA
mkl_dft_def_ownscDftFwd_Fact4_32fc	libmkl_def.so.2	0.11	0.09	0.09	0.12	0.01	0.01	0.02	0.02	64	64	64	64	0.11	0.08	0.09	0.12	0.02	0.01	0.01	0.01
mkl_dft_def_owns_cCcsRecombine_32f	libmkl_def.so.2	0.10	0.09	0.09	0.12	0.01	0.01	0.01	0.01	64	64	64	64	0.10	0.09	0.08	0.13	0.01	0.01	0.01	0.02
mkl_dft_def_ownscDftInv_Fact4_32fc	libmkl_def.so.2	0.11	0.09	0.09	0.11	0.01	0.01	0.01	0.01	64	64	64	64	0.13	0.09	0.08	0.10	0.02	0.01	0.01	0.01
int assignInteractionsForAtom<false>(AtomIndexSet const&, reverse_ilist_t const&, gmx_ga2la_t const&, gmx_domdec_zones_t const&, bool, int const, bool, float, t_pbc const, gmx::ArrayRef<gmx::BasicVector<float> const>, In...	libgromacs_mpi.so.9.0.0	NA	0.12	0.12	0.14	NA	0.02	0.02	0.02	NA	113	119	108	NA	0.15	0.15	0.19	NA	0.02	0.02	0.02
unknown_function	libgromacs_mpi.so.9.0.0	0.07	0.13	0.13	0.05	0.01	0.02	0.02	0.01	160	186	183	139	0.05	0.07	0.07	0.04	0.01	0.01	0.01	0.00
MPIDIG_send_target_msg_cb	libmpi.so.12.0.0	0.10	0.08	0.09	0.11	0.01	0.01	0.01	0.01	160	156	161	161	0.08	0.07	0.07	0.09	0.01	0.01	0.01	0.01
mkl_dft_def_owns_cRealRecombine_32f	libmkl_def.so.2	0.09	0.09	0.08	0.10	0.01	0.01	0.01	0.01	64	64	64	64	0.10	0.08	0.09	0.11	0.01	0.01	0.01	0.01
.plt.sec@start	libm.so.6	0.15	0.16	0.04	NA	0.02	0.03	0.01	NA	180	190	140	NA	0.08	0.08	0.03	NA	0.01	0.01	0.01	NA
constrained_atom_sigma2(float, AtomNonbondedAndKineticProperties const&, float, float)	libgromacs_mpi.so.9.0.0	0.34	NA	NA	NA	0.05	NA	NA	NA	192	NA	NA	NA	0.16	NA	NA	NA	0.02	NA	NA	NA
dd_move_x_specat(gmx_domdec_t const, gmx_domdec_specat_comm_t, float const () [3], gmx::BasicVector<float>, gmx::BasicVector<float>*, bool)	libgromacs_mpi.so.9.0.0	0.08	0.07	0.07	0.11	0.01	0.01	0.01	0.01	124	119	117	122	0.08	0.07	0.06	0.10	0.01	0.01	0.01	0.01
__memset_avx512_unaligned_erms	libc.so.6	0.09	0.12	0.11	NA	0.01	0.02	0.02	NA	172	190	185	NA	0.05	0.06	0.06	NA	0.01	0.01	0.01	NA
void gmx::settleTemplate<gmx::SimdFloat, gmx::SimdFBool, 16, float const, true, false>(gmx::SettleData const&, int, int, float const, float const, float, float, float, float () [3], bool*) [clone .constprop.0]	libgromacs_mpi.so.9.0.0	0.30	NA	NA	NA	0.04	NA	NA	NA	128	NA	NA	NA	0.21	NA	NA	NA	0.03	NA	NA	NA
(anonymous namespace)::dih_angle_simd(float const () [3], int const, int const, int const, int const, float const, gmx::SimdFloat, gmx::SimdFloat, gmx::SimdFloat, gmx::SimdFloat, gmx::SimdFloat, gmx::SimdFloat, gmx::SimdFloat, gmx::SimdFloat,...	libgromacs_mpi.so.9.0.0	0.29	NA	NA	NA	0.04	NA	NA	NA	103	NA	NA	NA	0.38	NA	NA	NA	0.05	NA	NA	NA
reduceForces(nbnxn_atomdata_t, gmx::AtomLocality, Nbnxm::GridSet const&, float () [3]) [clone .extracted]	libgromacs_mpi.so.9.0.0	NA	NA	NA	0.28	NA	NA	NA	0.03	NA	NA	NA	128	NA	NA	NA	0.14	NA	NA	NA	0.02
reduceForces(nbnxn_atomdata_t, gmx::AtomLocality, Nbnxm::GridSet const&, float () [3]) [clone ._omp_fn.0]	libgromacs_mpi.so.9.0.0	0.28	NA	NA	NA	0.04	NA	NA	NA	128	NA	NA	NA	0.14	NA	NA	NA	0.02	NA	NA	NA
pme_calc_pidx_wrapper(gmx::ArrayRef<gmx::BasicVector<float> const>, float const () [3], PmeAtomComm) [clone .extracted]	libgromacs_mpi.so.9.0.0	NA	NA	NA	0.26	NA	NA	NA	0.03	NA	NA	NA	64	NA	NA	NA	0.19	NA	NA	NA	0.02
void do_pairs_simple<gmx::SimdFloat, 16, float const>(int, int const, t_iparams const, float const () [3], float () [4], float const, gmx::ArrayRef<float const>, float)	libgromacs_mpi.so.9.0.0	NA	NA	NA	0.25	NA	NA	NA	0.03	NA	NA	NA	107	NA	NA	NA	0.37	NA	NA	NA	0.05
pme_calc_pidx_wrapper(gmx::ArrayRef<gmx::BasicVector<float> const>, float const () [3], PmeAtomComm) [clone ._omp_fn.0]	libgromacs_mpi.so.9.0.0	0.25	NA	NA	NA	0.03	NA	NA	NA	64	NA	NA	NA	0.17	NA	NA	NA	0.02	NA	NA	NA
_ZN12_GLOBAL__N_124do_dih_fup_noshiftf_simdEPKiS1_S1_S1_N3gmx9SimdFloatES3_S3_S3_S3_S3_S3_S3_PA4_f@@608	libgromacs_mpi.so.9.0.0	NA	0.12	0.13	NA	NA	0.02	0.02	NA	NA	102	100	NA	NA	0.17	0.17	NA	NA	0.03	0.03	NA
gmx_sum_qgrid_dd(gmx_pme_t, float, int)	libgromacs_mpi.so.9.0.0	0.08	0.06	0.06	0.04	0.01	0.01	0.01	0.01	63	64	64	59	0.10	0.08	0.07	0.08	0.01	0.01	0.01	0.01
MPI_Waitall	libmpi.so.12.0.0	0.06	0.05	0.06	0.07	0.01	0.01	0.01	0.01	144	130	150	140	0.05	0.04	0.05	0.05	0.01	0.01	0.01	0.01
std::enable_if<(((BondedKernelFlavor)2)!=((BondedKernelFlavor)0))\|\|(!(1)), float>::type (anonymous namespace)::angles<(BondedKernelFlavor)2>(int, int const, t_iparams const, float const () [3], float () [4], float () [3], t_pbc const, flo...	libgromacs_mpi.so.9.0.0	0.05	0.05	0.05	0.07	0.01	0.01	0.01	0.01	85	85	84	89	0.08	0.07	0.07	0.09	0.01	0.01	0.01	0.01
.omp_outlined.#0xc0cfb0	libgromacs_mpi.so.9.0.0	NA	NA	0.21	NA	NA	NA	0.03	NA	NA	NA	64	NA	NA	NA	0.15	NA	NA	NA	0.02	NA
MPIDI_GPU_request_free	libmpi.so.12.0.0	0.05	0.05	0.05	0.06	0.01	0.01	0.01	0.01	127	132	132	136	0.05	0.05	0.04	0.05	0.01	0.01	0.01	0.01
.omp_outlined.#0xc0af60	libgromacs_mpi.so.9.0.0	NA	0.20	NA	NA	NA	0.03	NA	NA	NA	64	NA	NA	NA	0.17	NA	NA	NA	0.03	NA	NA
spread_on_grid(gmx_pme_t const, PmeAtomComm, pmegrids_t const, bool, bool, float, bool, int) [clone ._omp_fn.0]	libgromacs_mpi.so.9.0.0	0.18	NA	NA	NA	0.02	NA	NA	NA	64	NA	NA	NA	0.15	NA	NA	NA	0.02	NA	NA	NA
gmx_pme_receive_f(gmx::PmePpCommGpu, t_commrec const, gmx::ForceWithVirial, float, float, float, float, bool, bool, float)	libgromacs_mpi.so.9.0.0	0.01	0.05	0.05	0.05	0.00	0.01	0.01	0.01	53	118	114	109	0.02	0.05	0.05	0.05	0.00	0.01	0.01	0.01
spread_on_grid(gmx_pme_t const, PmeAtomComm, pmegrids_t const, bool, bool, float, bool, int) [clone .extracted.18]	libgromacs_mpi.so.9.0.0	NA	NA	NA	0.17	NA	NA	NA	0.02	NA	NA	NA	64	NA	NA	NA	0.18	NA	NA	NA	0.02
void make_exclusions_zone<false>(gmx::ArrayRef<int const>, gmx_ga2la_t const&, gmx_domdec_zones_t const&, gmx::ArrayRef<MolblockIndices const>, std::vector<gmx_moltype_t, std::allocator<gmx_moltype_t> > const&, gmx...	libgromacs_mpi.so.9.0.0	NA	0.05	0.05	0.07	NA	0.01	0.01	0.01	NA	112	116	113	NA	0.05	0.04	0.07	NA	0.01	0.01	0.01
void do_dih_fup<(BondedKernelFlavor)2>(int, int, int, int, float, float, float, float, float, float, float () [4], float () [3], t_pbc const, float const (*) [3], int, int, int)	libgromacs_mpi.so.9.0.0	NA	0.05	0.06	0.06	NA	0.01	0.01	0.01	NA	86	93	84	NA	0.07	0.09	0.09	NA	0.01	0.01	0.01
atanf	libm.so.6	0.08	0.07	NA	NA	0.01	0.01	NA	NA	88	96	NA	NA	0.10	0.09	NA	NA	0.01	0.01	NA	NA
_ZN12_GLOBAL__N_124do_dih_fup_noshiftf_simdEPKiS1_S1_S1_N3gmx9SimdFloatES3_S3_S3_S3_S3_S3_S3_PA4_f@@776	libgromacs_mpi.so.9.0.0	NA	NA	NA	0.15	NA	NA	NA	0.02	NA	NA	NA	93	NA	NA	NA	0.23	NA	NA	NA	0.03
copy_fftgrid_to_pmegrid(gmx_pme_t, float const, float*, int, int, int)	libgromacs_mpi.so.9.0.0	0.05	0.05	0.05	0.01	0.01	0.01	0.01	0.00	62	64	63	33	0.07	0.07	0.07	0.02	0.01	0.01	0.01	0.00
MPIR_Sendrecv_impl	libmpi.so.12.0.0	0.04	0.03	0.03	0.04	0.01	0.00	0.01	0.01	123	115	125	119	0.03	0.03	0.03	0.03	0.00	0.00	0.00	0.00
__intel_avx_rep_memset	binary	NA	NA	NA	0.15	NA	NA	NA	0.02	NA	NA	NA	185	NA	NA	NA	0.08	NA	NA	NA	0.01
.omp_outlined.#0xc15900	libgromacs_mpi.so.9.0.0	NA	NA	0.14	NA	NA	NA	0.02	NA	NA	NA	64	NA	NA	NA	0.11	NA	NA	NA	0.02	NA
int assignInteractionsForAtom<false>(AtomIndexSet const&, reverse_ilist_t const&, gmx_ga2la_t const&, gmx_domdec_zones_t const&, bool, int const, bool, float, t_pbc const, gmx::ArrayRef<gmx::BasicVector<float> const>, In...	libgromacs_mpi.so.9.0.0	0.14	NA	NA	NA	0.02	NA	NA	NA	111	NA	NA	NA	0.18	NA	NA	NA	0.02	NA	NA	NA
mkl_dft_def_ownscDftInv_PrimeFact_32fc	libmkl_def.so.2	0.04	0.03	0.03	0.04	0.01	0.00	0.01	0.01	60	59	59	60	0.06	0.04	0.05	0.07	0.01	0.01	0.01	0.01
__I_MPI___intel_avx_rep_memcpy	libmpifort.so.12.0.0	0.04	0.03	0.03	0.04	0.01	0.01	0.00	0.00	110	117	105	114	0.04	0.03	0.03	0.04	0.01	0.00	0.00	0.01
std::enable_if<(((BondedKernelFlavor)2)!=((BondedKernelFlavor)0))\|\|(!(1)), float>::type (anonymous namespace)::pdihs<(BondedKernelFlavor)2>(int, int const, t_iparams const, float const () [3], float () [4], float () [3], t_pbc const, floa...	libgromacs_mpi.so.9.0.0	0.04	0.03	0.03	0.04	0.01	0.00	0.01	0.01	75	65	75	72	0.07	0.05	0.06	0.07	0.01	0.01	0.01	0.01
.omp_outlined.#0xc138b0	libgromacs_mpi.so.9.0.0	NA	0.14	NA	NA	NA	0.02	NA	NA	NA	64	NA	NA	NA	0.12	NA	NA	NA	0.02	NA	NA
__intel_avx_rep_memcpy	binary	NA	NA	NA	0.14	NA	NA	NA	0.02	NA	NA	NA	77	NA	NA	NA	0.19	NA	NA	NA	0.02
mkl_dft_def_ownscDftFwd_PrimeFact_32fc	libmkl_def.so.2	0.04	0.03	0.03	0.04	0.00	0.00	0.01	0.00	61	60	60	62	0.05	0.06	0.05	0.06	0.01	0.01	0.01	0.01
setup_specat_communication(gmx_domdec_t, std::vector<int, std::allocator<int> >, gmx_domdec_specat_comm_t, gmx::HashedMap<int>, int, int, char const, char const)	libgromacs_mpi.so.9.0.0	0.04	0.03	0.03	0.04	0.01	0.00	0.01	0.00	99	87	101	97	0.04	0.04	0.04	0.04	0.01	0.01	0.01	0.01
copy_pmegrid_to_fftgrid(gmx_pme_t const, float const, float*, int)	libgromacs_mpi.so.9.0.0	0.05	0.04	0.04	0.00	0.01	0.01	0.01	0.00	62	63	63	12	0.07	0.06	0.06	0.01	0.01	0.01	0.01	0.00
MPID_Progress_idle_timer_tick	libmpi.so.12.0.0	0.03	0.03	0.03	0.03	0.00	0.01	0.01	0.00	85	100	110	86	0.04	0.04	0.03	0.03	0.00	0.01	0.01	0.00
MPIDIG_progress_compl_list	libmpi.so.12.0.0	0.03	0.03	0.02	0.04	0.00	0.00	0.00	0.00	111	109	92	110	0.03	0.03	0.03	0.04	0.00	0.00	0.00	0.00
gmx::dd_partition_system(_IO_FILE, gmx::MDLogger const&, long, t_commrec const, bool, t_state, gmx_mtop_t const&, t_inputrec const&, gmx::MDModulesNotifiers const&, gmx::ImdSession, pull_t, t_state, gmx::ForceBuffers, gmx::MDAtoms, ...	libgromacs_mpi.so.9.0.0	0.01	0.03	0.04	0.04	0.00	0.01	0.01	0.01	47	101	109	100	0.02	0.04	0.03	0.04	0.00	0.01	0.01	0.00
dih_angle(float const, float const, float const, float const, t_pbc const, float, float, float, float, float, int, int, int*)	libgromacs_mpi.so.9.0.0	0.03	0.02	0.03	0.04	0.00	0.00	0.00	0.01	71	72	73	78	0.05	0.03	0.04	0.07	0.01	0.01	0.01	0.01
Nbnxm::sort_atoms(int, bool, int, bool, int*, int, gmx::ArrayRef<gmx::BasicVector<float> const>, float, float, int, gmx::ArrayRef<int>)	libgromacs_mpi.so.9.0.0	NA	0.04	0.04	0.04	NA	0.01	0.01	0.01	NA	103	109	99	NA	0.03	0.03	0.06	NA	0.01	0.01	0.01
erfcf	binary	NA	NA	NA	0.12	NA	NA	NA	0.01	NA	NA	NA	177	NA	NA	NA	0.07	NA	NA	NA	0.01
MPI_T_category_get_pvars	libmpi.so.12.0.0	0.03	0.03	0.03	0.03	0.00	0.00	0.00	0.00	101	99	104	92	0.04	0.03	0.03	0.03	0.00	0.01	0.00	0.00
do_force(_IO_FILE, t_commrec const, gmx_multisim_t const, t_inputrec const&, gmx::MDModulesNotifiers const&, gmx::Awh, gmx_enfrot, gmx::ImdSession, pull_t, long, t_nrnb, gmx_wallcycle, gmx_localtop_t const, float const (*) [3], gmx::Array...	libgromacs_mpi.so.9.0.0	0.04	0.03	0.02	0.03	0.01	0.00	0.00	0.00	102	83	86	83	0.04	0.03	0.03	0.03	0.01	0.00	0.00	0.00
MPI_Isend	libmpi.so.12.0.0	0.03	0.03	0.02	0.03	0.00	0.00	0.00	0.00	107	99	89	82	0.03	0.04	0.03	0.04	0.00	0.01	0.00	0.00
evaluate_single(float, float, float const, float, float, float, float, float, float*)	libgromacs_mpi.so.9.0.0	0.06	NA	NA	0.05	0.01	NA	NA	0.01	82	NA	NA	87	0.09	NA	NA	0.07	0.01	NA	NA	0.01
std::enable_if<((BondedKernelFlavor)0)==((BondedKernelFlavor)0), float>::type (anonymous namespace)::rbdihs<(BondedKernelFlavor)0>(int, int const, t_iparams const, float const () [3], float () [4], float () [3], t_pbc const, float, float*...	libgromacs_mpi.so.9.0.0	0.02	0.03	0.03	0.03	0.00	0.00	0.00	0.00	32	42	30	34	0.08	0.10	0.10	0.12	0.01	0.02	0.02	0.01
expf	binary	NA	NA	NA	0.10	NA	NA	NA	0.01	NA	NA	NA	175	NA	NA	NA	0.06	NA	NA	NA	0.01
gmx::LegacySimulator::do_md()	libgromacs_mpi.so.9.0.0	0.02	0.03	0.02	0.03	0.00	0.00	0.00	0.00	79	87	82	84	0.03	0.03	0.03	0.04	0.00	0.00	0.00	0.00
getVerletBufferAtomtypes(gmx_mtop_t const&, bool, bool)	libgromacs_mpi.so.9.0.0	0.03	0.03	0.03	0.01	0.00	0.00	0.00	0.00	95	99	110	36	0.03	0.03	0.02	0.01	0.00	0.00	0.00	0.00
__acosf_finite	libm.so.6	0.05	0.04	NA	NA	0.01	0.01	NA	NA	83	83	NA	NA	0.07	0.06	NA	NA	0.01	0.01	NA	NA
gmx::Update::Impl::update_coords(t_inputrec const&, long, int, bool, gmx::ArrayRef<ParticleType const>, gmx::ArrayRef<float const>, gmx::ArrayRef<gmx::BasicVector<float> const>, t_state*, gmx::ArrayRefWithPadding<gmx::BasicVe...	libgromacs_mpi.so.9.0.0	NA	NA	NA	0.09	NA	NA	NA	0.01	NA	NA	NA	124	NA	NA	NA	0.07	NA	NA	NA	0.01
Nbnxm::Grid::fillCell(Nbnxm::GridSetData, nbnxn_atomdata_t, int, int, gmx::ArrayRef<long const>, gmx::ArrayRef<gmx::BasicVector<float> const>, Nbnxm::BoundingBox*)	libgromacs_mpi.so.9.0.0	0.02	0.02	0.02	0.03	0.00	0.00	0.00	0.00	77	78	71	91	0.03	0.02	0.03	0.03	0.00	0.00	0.00	0.00
DftiComputeBackward	libmkl_intel_lp64.so.2	0.02	0.02	0.02	0.02	0.00	0.00	0.00	0.00	51	55	51	50	0.05	0.03	0.04	0.05	0.01	0.01	0.01	0.01
mkl_dft_def_ippsFFTInv_CCSToR_32f	libmkl_def.so.2	0.02	0.02	0.02	0.03	0.00	0.00	0.00	0.00	50	53	56	57	0.04	0.04	0.04	0.05	0.01	0.01	0.01	0.01
gomp_team_barrier_wait_end	libgomp.so.1.0.0	0.08	NA	NA	NA	0.01	NA	NA	NA	167	NA	NA	NA	0.05	NA	NA	NA	0.01	NA	NA	NA
MPIR_Sendrecv_replace_impl	libmpi.so.12.0.0	0.02	0.02	0.02	0.03	0.00	0.00	0.00	0.00	73	74	77	83	0.03	0.02	0.02	0.03	0.00	0.00	0.00	0.00
.omp_outlined..17	libgromacs_mpi.so.9.0.0	NA	0.04	0.04	NA	NA	0.01	0.01	NA	NA	92	88	NA	NA	0.05	0.06	NA	NA	0.01	0.01	NA
amd_ref_atan2f	libalm.so	NA	NA	0.08	NA	NA	NA	0.01	NA	NA	NA	91	NA	NA	NA	0.11	NA	NA	NA	0.02	NA
do_lookup_x	ld-linux-x86-64.so.2	0.01	0.02	0.03	0.02	0.00	0.00	0.00	0.00	56	105	112	80	0.01	0.01	0.02	0.01	0.00	0.00	0.00	0.00
MPIR_Waitall	libmpi.so.12.0.0	0.02	0.02	0.02	0.02	0.00	0.00	0.00	0.00	52	47	53	54	0.05	0.03	0.03	0.04	0.01	0.01	0.00	0.00
atoms2md(gmx_mtop_t const&, t_inputrec const&, int, gmx::ArrayRef<int>, int, gmx::MDAtoms*) [clone .extracted]	libgromacs_mpi.so.9.0.0	NA	NA	NA	0.08	NA	NA	NA	0.01	NA	NA	NA	119	NA	NA	NA	0.07	NA	NA	NA	0.01
.omp_outlined.	libgromacs_mpi.so.9.0.0	NA	0.04	0.04	NA	NA	0.01	0.01	NA	NA	110	105	NA	NA	0.03	0.04	NA	NA	0.01	0.01	NA
DftiComputeForward	libmkl_intel_lp64.so.2	0.02	0.02	0.01	0.02	0.00	0.00	0.00	0.00	57	44	42	46	0.05	0.04	0.03	0.04	0.01	0.01	0.01	0.00
bond_angle(float const, float const, float const, t_pbc const, float, float, float, int, int*)	libgromacs_mpi.so.9.0.0	0.03	0.01	0.01	0.02	0.00	0.00	0.00	0.00	65	44	49	67	0.05	0.02	0.03	0.04	0.01	0.00	0.00	0.00
void gmx::(anonymous namespace)::reduceThreadForceBuffers<float [4]>(gmx::ArrayRef<gmx::BasicVector<float> >, gmx::ArrayRef<std::unique_ptr<gmx::ThreadForceBuffer<float [4]>, std::default_delete<gmx::ThreadForceBuffer<fl...	libgromacs_mpi.so.9.0.0	NA	NA	NA	0.07	NA	NA	NA	0.01	NA	NA	NA	106	NA	NA	NA	0.08	NA	NA	NA	0.01
.omp_outlined..70	libgromacs_mpi.so.9.0.0	NA	0.03	0.04	NA	NA	0.01	0.01	NA	NA	102	108	NA	NA	0.03	0.04	NA	NA	0.01	0.01	NA
gmx::ThreadForceBuffer<float [4]>::clearForcesAndEnergies()	libgromacs_mpi.so.9.0.0	0.02	0.02	0.02	0.02	0.00	0.00	0.00	0.00	62	57	67	62	0.03	0.03	0.02	0.03	0.00	0.01	0.00	0.00
MPIDI_GPU_request_complete	libmpi.so.12.0.0	0.02	0.01	0.02	0.02	0.00	0.00	0.00	0.00	85	68	82	70	0.02	0.02	0.01	0.02	0.00	0.00	0.00	0.00
.omp_outlined..65	libgromacs_mpi.so.9.0.0	NA	0.04	0.03	NA	NA	0.01	0.01	NA	NA	103	102	NA	NA	0.04	0.04	NA	NA	0.01	0.01	NA
atoms2md(gmx_mtop_t const&, t_inputrec const&, int, gmx::ArrayRef<int>, int, gmx::MDAtoms*) [clone ._omp_fn.0]	libgromacs_mpi.so.9.0.0	0.07	NA	NA	NA	0.01	NA	NA	NA	122	NA	NA	NA	0.05	NA	NA	NA	0.01	NA	NA	NA
void make_exclusions_zone<false>(gmx::ArrayRef<int const>, gmx_ga2la_t const&, gmx_domdec_zones_t const&, gmx::ArrayRef<MolblockIndices const>, std::vector<gmx_moltype_t, std::allocator<gmx_moltype_t> > const&, gmx...	libgromacs_mpi.so.9.0.0	0.07	NA	NA	NA	0.01	NA	NA	NA	115	NA	NA	NA	0.06	NA	NA	NA	0.01	NA	NA	NA
MPI_Irecv	libmpi.so.12.0.0	0.02	0.01	0.02	0.02	0.00	0.00	0.00	0.00	72	54	75	70	0.02	0.02	0.02	0.02	0.00	0.00	0.00	0.00
MPI_Sendrecv	libmpi.so.12.0.0	0.02	0.01	0.01	0.02	0.00	0.00	0.00	0.00	75	64	59	66	0.02	0.02	0.02	0.03	0.00	0.00	0.00	0.00
.omp_outlined..4	libgromacs_mpi.so.9.0.0	NA	0.03	0.03	NA	NA	0.01	0.01	NA	NA	98	102	NA	NA	0.04	0.03	NA	NA	0.01	0.00	NA
MPIR_Request_completion_processing	libmpi.so.12.0.0	0.02	0.01	0.01	0.02	0.00	0.00	0.00	0.00	63	61	57	63	0.03	0.02	0.02	0.02	0.00	0.00	0.00	0.00
.omp_outlined.#0xb0bc10	libgromacs_mpi.so.9.0.0	NA	NA	0.06	NA	NA	NA	0.01	NA	NA	NA	124	NA	NA	NA	0.05	NA	NA	NA	0.01	NA
mpi_combiner_2_hcoll_combiner	libmpi.so.12.0.0	0.02	0.01	0.01	0.02	0.00	0.00	0.00	0.00	49	48	48	52	0.04	0.03	0.02	0.04	0.00	0.00	0.00	0.00
int make_bondeds_zone<false>(gmx_reverse_top_t const&, gmx::ArrayRef<int const>, gmx_ga2la_t const&, gmx_domdec_zones_t const&, std::vector<gmx_molblock_t, std::allocator<gmx_molblock_t> > const&, bool, int const*, b...	libgromacs_mpi.so.9.0.0	NA	0.02	0.02	0.02	NA	0.00	0.00	0.00	NA	82	75	65	NA	0.03	0.02	0.03	NA	0.00	0.00	0.00
gmx_pmeonly(gmx_pme_t*, t_commrec const, t_nrnb, gmx_wallcycle, gmx_walltime_accounting, t_inputrec, PmeRunMode, bool, bool, gmx::DeviceStreamManager const*)	libgromacs_mpi.so.9.0.0	0.02	0.02	0.01	0.01	0.00	0.00	0.00	0.00	45	53	45	41	0.03	0.03	0.02	0.03	0.00	0.01	0.00	0.00
void do_dih_fup<(BondedKernelFlavor)2>(int, int, int, int, float, float, float, float, float, float, float () [4], float () [3], t_pbc const, float const (*) [3], int, int, int) [clone .isra.0]	libgromacs_mpi.so.9.0.0	0.06	NA	NA	NA	0.01	NA	NA	NA	87	NA	NA	NA	0.10	NA	NA	NA	0.01	NA	NA	NA
.omp_outlined.#0xb09d40	libgromacs_mpi.so.9.0.0	NA	0.06	NA	NA	NA	0.01	NA	NA	NA	117	NA	NA	NA	0.05	NA	NA	NA	0.01	NA	NA
__libm_atan2f_z0	binary	NA	NA	NA	0.06	NA	NA	NA	0.01	NA	NA	NA	88	NA	NA	NA	0.08	NA	NA	NA	0.01
__GI___libc_malloc	libc.so.6	0.01	0.01	0.02	0.01	0.00	0.00	0.00	0.00	49	67	82	50	0.02	0.02	0.02	0.02	0.00	0.00	0.00	0.00
MPI_Recv	libmpi.so.12.0.0	0.02	0.01	0.01	0.01	0.00	0.00	0.00	0.00	68	58	67	60	0.02	0.01	0.01	0.02	0.00	0.00	0.00	0.00
MPIDU_Init_shm_barrier	libmpi.so.12.0.0	0.01	0.01	0.02	0.02	0.00	0.00	0.00	0.00	40	62	75	59	0.01	0.03	0.03	0.03	0.00	0.00	0.01	0.00
__libm_sincosf_e7	binary	NA	NA	NA	0.06	NA	NA	NA	0.01	NA	NA	NA	79	NA	NA	NA	0.10	NA	NA	NA	0.01
void calc_ke_part_normal<false>(float const () [3], gmx::ArrayRef<gmx::BasicVector<float> const>, gmx::ArrayRef<gmx::BasicVector<float> const>, float const () [3], t_grpopts const, t_mdatoms const, gmx_ekindata_t, t_nrnb...	libgromacs_mpi.so.9.0.0	NA	NA	NA	0.05	NA	NA	NA	0.01	NA	NA	NA	108	NA	NA	NA	0.06	NA	NA	NA	0.01
__kmpc_end_serialized_parallel	libomp.so	NA	0.03	0.03	NA	NA	0.00	0.00	NA	NA	106	115	NA	NA	0.02	0.02	NA	NA	0.00	0.00	NA
MPIC_Isend	libmpi.so.12.0.0	0.01	0.01	0.01	0.02	0.00	0.00	0.00	0.00	42	49	39	42	0.02	0.03	0.03	0.04	0.00	0.00	0.00	0.00
__kmp_fork_call	libomp.so	NA	0.03	0.02	NA	NA	0.00	0.00	NA	NA	113	110	NA	NA	0.02	0.02	NA	NA	0.00	0.00	NA
compute_1d_small_bwd	libmkl_def.so.2	0.01	0.01	0.01	0.02	0.00	0.00	0.00	0.00	39	44	38	44	0.04	0.03	0.03	0.03	0.01	0.00	0.00	0.00
setup_dd_communication(gmx_domdec_t, float () [3], gmx_ddbox_t, t_forcerec, t_state*) [clone ._omp_fn.0]	libgromacs_mpi.so.9.0.0	0.05	NA	NA	NA	0.01	NA	NA	NA	115	NA	NA	NA	0.05	NA	NA	NA	0.01	NA	NA	NA
mkl_dft_def_ippsDFTInv_CToC_32fc	libmkl_def.so.2	0.02	0.01	0.01	0.01	0.00	0.00	0.00	0.00	48	36	43	42	0.04	0.03	0.02	0.03	0.01	0.01	0.00	0.00
calc_x_times_f(int, float const () [3], float const () [3], bool, float const () [3], float () [3])	libgromacs_mpi.so.9.0.0	0.02	0.02	0.01	NA	0.00	0.00	0.00	NA	67	64	65	NA	0.02	0.02	0.02	NA	0.00	0.00	0.00	NA
__atan2f_finite	libm.so.6	0.03	0.02	NA	NA	0.00	0.00	NA	NA	69	65	NA	NA	0.05	0.03	NA	NA	0.01	0.00	NA	NA
gmx_pme_do(gmx_pme_t*, gmx::ArrayRef<gmx::BasicVector<float> const>, gmx::ArrayRef<gmx::BasicVector<float> >, gmx::ArrayRef<float const>, gmx::ArrayRef<float const>, gmx::ArrayRef<float const>, gmx::ArrayRef<flo...	libgromacs_mpi.so.9.0.0	0.02	0.01	0.01	0.01	0.00	0.00	0.00	0.00	46	32	37	42	0.04	0.03	0.02	0.03	0.01	0.01	0.00	0.00
make_dd_indices(gmx_domdec_t*, int)	libgromacs_mpi.so.9.0.0	0.01	0.01	0.01	0.01	0.00	0.00	0.00	0.00	49	51	50	52	0.02	0.02	0.02	0.02	0.00	0.00	0.00	0.00
amd_sinf_zn4	libalm.so	NA	NA	0.05	NA	NA	NA	0.01	NA	NA	NA	87	NA	NA	NA	0.08	NA	NA	NA	0.01	NA
gmx::constr_recur(gmx::ListOfLists<int> const&, std::array<InteractionList, 94ul> const&, gmx::ArrayRef<t_iparams const>, bool, int, int, int, gmx::ArrayRef<int>, float, float, float, int)	libgromacs_mpi.so.9.0.0	NA	0.02	0.02	0.01	NA	0.00	0.00	0.00	NA	105	100	66	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00
wrap_periodic_pmegrid(gmx_pme_t const, float)	libgromacs_mpi.so.9.0.0	0.01	0.01	0.01	0.01	0.00	0.00	0.00	0.00	41	43	47	38	0.03	0.02	0.03	0.03	0.00	0.00	0.01	0.00
setup_dd_communication(gmx_domdec_t, float () [3], gmx_ddbox_t, t_forcerec, t_state*) [clone .extracted]	libgromacs_mpi.so.9.0.0	NA	NA	NA	0.05	NA	NA	NA	0.01	NA	NA	NA	104	NA	NA	NA	0.04	NA	NA	NA	0.01
mkl_dft_def_ippsFFTFwd_RToPerm_32f	libmkl_def.so.2	0.01	0.01	0.01	0.01	0.00	0.00	0.00	0.00	44	40	41	37	0.03	0.03	0.03	0.03	0.00	0.00	0.00	0.00
globalAtomIndexToMoltypeIndices(gmx::ArrayRef<MolblockIndices const>, int)	libgromacs_mpi.so.9.0.0	0.01	0.01	0.01	0.02	0.00	0.00	0.00	0.00	49	48	47	56	0.02	0.02	0.02	0.03	0.00	0.00	0.00	0.00
_dl_lookup_symbol_x	ld-linux-x86-64.so.2	0.01	0.01	0.01	0.01	0.00	0.00	0.00	0.00	46	51	72	58	0.01	0.01	0.01	0.01	0.00	0.00	0.00	0.00
.omp_outlined.#0x6c2070	libgromacs_mpi.so.9.0.0	NA	0.05	NA	NA	NA	0.01	NA	NA	NA	114	NA	NA	NA	0.04	NA	NA	NA	0.01	NA	NA
_int_free	libc.so.6	0.02	0.01	0.01	0.01	0.00	0.00	0.00	0.00	82	44	60	26	0.02	0.01	0.01	0.01	0.00	0.00	0.00	0.00
__tls_get_addr	ld-linux-x86-64.so.2	0.01	0.01	0.01	0.01	0.00	0.00	0.00	0.00	37	57	58	51	0.02	0.02	0.02	0.02	0.00	0.00	0.00	0.00
setupForceOutputs(ForceHelperBuffers, gmx::ArrayRefWithPadding<gmx::BasicVector<float> >, gmx::DomainLifetimeWorkload const&, gmx::StepWorkload const&, bool, gmx_wallcycle) [clone .isra.0]	libgromacs_mpi.so.9.0.0	0.05	NA	NA	NA	0.01	NA	NA	NA	107	NA	NA	NA	0.04	NA	NA	NA	0.01	NA	NA	NA
gmx::InMemoryDeserializer::doInt(int*)	libgromacs_mpi.so.9.0.0	0.01	0.01	0.01	0.01	0.00	0.00	0.00	0.00	31	84	67	68	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
MPIDIG_send_long_req_target_msg_cb	libmpi.so.12.0.0	0.01	0.01	0.01	0.01	0.00	0.00	0.00	0.00	56	52	48	45	0.02	0.02	0.01	0.02	0.00	0.00	0.00	0.00
nbnxn_atomdata_copy_x_to_nbat_x(Nbnxm::GridSet const&, gmx::AtomLocality, float const () [3], nbnxn_atomdata_t) [clone .extracted]	libgromacs_mpi.so.9.0.0	NA	NA	NA	0.04	NA	NA	NA	0.01	NA	NA	NA	105	NA	NA	NA	0.05	NA	NA	NA	0.01
MPIDIG_dequeue_unexp	libmpi.so.12.0.0	0.01	0.01	0.01	0.01	0.00	0.00	0.00	0.00	58	47	47	49	0.02	0.01	0.01	0.02	0.00	0.00	0.00	0.00
void calc_ke_part_normal<false>(float const () [3], gmx::ArrayRef<gmx::BasicVector<float> const>, gmx::ArrayRef<gmx::BasicVector<float> const>, float const () [3], t_grpopts const, t_mdatoms const, gmx_ekindata_t, t_nrnb...	libgromacs_mpi.so.9.0.0	0.04	NA	NA	NA	0.01	NA	NA	NA	102	NA	NA	NA	0.05	NA	NA	NA	0.01	NA	NA	NA
do_update_md(int, int, float, long, float const () [3], float () [3], float () [3], float const () [3], TemperatureCoupling, PressureCoupling, int, int, gmx::ArrayRef<unsigned short const>, AccelerationType, gmx::ArrayRef<unsigned short const&...	libgromacs_mpi.so.9.0.0	0.04	NA	NA	NA	0.01	NA	NA	NA	105	NA	NA	NA	0.04	NA	NA	NA	0.01	NA	NA	NA
mkl_dft_def_ippsDFTFwd_CToC_32fc	libmkl_def.so.2	0.01	0.01	0.01	0.01	0.00	0.00	0.00	0.00	34	38	45	39	0.02	0.02	0.03	0.03	0.00	0.00	0.00	0.00
gmx_fft_1d(gmx_fft, gmx_fft_direction, void, void*)	libgromacs_mpi.so.9.0.0	0.01	0.01	0.01	0.01	0.00	0.00	0.00	0.00	38	36	38	43	0.03	0.02	0.02	0.03	0.00	0.00	0.00	0.00
malloc_consolidate	libc.so.6	0.04	0.00	0.00	0.00	0.01	0.00	0.00	0.00	122	8	3	10	0.03	0.00	0.00	0.00	0.00	0.00	0.00	0.00
exp	binary	NA	NA	NA	0.04	NA	NA	NA	0.01	NA	NA	NA	121	NA	NA	NA	0.03	NA	NA	NA	0.00
.omp_outlined.#0x6c2410	libgromacs_mpi.so.9.0.0	NA	NA	0.04	NA	NA	NA	0.01	NA	NA	NA	107	NA	NA	NA	0.04	NA	NA	NA	0.01	NA
__kmp_serialized_parallel	libomp.so	NA	0.02	0.02	NA	NA	0.00	0.00	NA	NA	85	85	NA	NA	0.02	0.02	NA	NA	0.00	0.00	NA
compute_1d_small_fwd	libmkl_def.so.2	0.01	0.01	0.01	0.01	0.00	0.00	0.00	0.00	39	35	28	37	0.03	0.02	0.03	0.02	0.00	0.00	0.00	0.00
Nbnxm::sort_atoms(int, bool, int, bool, int*, int, gmx::ArrayRef<gmx::BasicVector<float> const>, float, float, int, gmx::ArrayRef<int>) [clone .constprop.2] [clone .isra.0]	libgromacs_mpi.so.9.0.0	0.04	NA	NA	NA	0.01	NA	NA	NA	105	NA	NA	NA	0.04	NA	NA	NA	0.00	NA	NA	NA
__kmp_fork_call	libiomp5.so	NA	NA	NA	0.04	NA	NA	NA	0.00	NA	NA	NA	113	NA	NA	NA	0.03	NA	NA	NA	0.00
Nbnxm::Grid::sortColumnsCpuGeometry(Nbnxm::GridSetData, int, gmx::ArrayRef<long const>, gmx::ArrayRef<gmx::BasicVector<float> const>, nbnxn_atomdata_t, gmx::Range<int>, gmx::ArrayRef<int>)	libgromacs_mpi.so.9.0.0	0.01	0.01	0.01	0.01	0.00	0.00	0.00	0.00	25	49	44	47	0.02	0.02	0.02	0.02	0.00	0.00	0.00	0.00
gmx::Constraints::Impl::apply(bool, bool, long, int, float, gmx::ArrayRefWithPadding<gmx::BasicVector<float> >, gmx::ArrayRefWithPadding<gmx::BasicVector<float> >, gmx::ArrayRef<gmx::BasicVector<float> >, float const (*)...	libgromacs_mpi.so.9.0.0	0.01	0.01	0.01	0.01	0.00	0.00	0.00	0.00	58	36	32	40	0.02	0.01	0.01	0.02	0.00	0.00	0.00	0.00
nbnxn_atomdata_copy_x_to_nbat_x(Nbnxm::GridSet const&, gmx::AtomLocality, float const () [3], nbnxn_atomdata_t) [clone ._omp_fn.0]	libgromacs_mpi.so.9.0.0	0.04	NA	NA	NA	0.00	NA	NA	NA	102	NA	NA	NA	0.04	NA	NA	NA	0.00	NA	NA	NA
void gmx::settleTemplate<gmx::SimdFloat, gmx::SimdFBool, 16, float const, true, true>(gmx::SettleData const&, int, int, float const, float const, float, float, float, float () [3], bool*)	libgromacs_mpi.so.9.0.0	0.04	NA	NA	NA	0.00	NA	NA	NA	93	NA	NA	NA	0.05	NA	NA	NA	0.01	NA	NA	NA
amd_acosf_zn4	libalm.so	NA	NA	0.04	NA	NA	NA	0.01	NA	NA	NA	83	NA	NA	NA	0.05	NA	NA	NA	0.01	NA
mkl_serv_verbose_mode	libmkl_core.so.2	0.01	0.01	0.01	0.01	0.00	0.00	0.00	0.00	33	37	38	29	0.02	0.03	0.02	0.02	0.00	0.00	0.00	0.00
nbnxn_atomdata_set(nbnxn_atomdata_t*, Nbnxm::GridSet const&, gmx::ArrayRef<int const>, gmx::ArrayRef<float const>, gmx::ArrayRef<long const>)	libgromacs_mpi.so.9.0.0	0.01	0.01	0.01	0.01	0.00	0.00	0.00	0.00	30	43	38	42	0.02	0.01	0.02	0.02	0.00	0.00	0.00	0.00
gmx::Update::Impl::finish_update(t_inputrec const&, bool, int, gmx::ArrayRef<unsigned short const>, t_state, gmx_wallcycle, bool) [clone ._omp_fn.0]	libgromacs_mpi.so.9.0.0	0.03	NA	NA	NA	0.00	NA	NA	NA	98	NA	NA	NA	0.03	NA	NA	NA	0.00	NA	NA	NA
amd_exp	libalm.so	NA	NA	0.03	NA	NA	NA	0.01	NA	NA	NA	123	NA	NA	NA	0.03	NA	NA	NA	0.00	NA
gmx::Update::Impl::finish_update(t_inputrec const&, bool, int, gmx::ArrayRef<unsigned short const>, t_state, gmx_wallcycle, bool) [clone .extracted]	libgromacs_mpi.so.9.0.0	NA	NA	NA	0.03	NA	NA	NA	0.00	NA	NA	NA	93	NA	NA	NA	0.04	NA	NA	NA	0.00
walk_out(int, int, int, int, int, gmx::ArrayRef<int const>, gmx::ArrayRef<int const>, gmx::ListOfLists<int> const&, gmx_ga2la_t const&, bool, gmx_domdec_constraints_t, gmx_domdec_specat_comm_t, InteractionList*, std::vector<i...	libgromacs_mpi.so.9.0.0	NA	0.01	0.01	0.01	NA	0.00	0.00	0.00	NA	47	45	40	NA	0.02	0.02	0.03	NA	0.00	0.00	0.00
MPIU_Selection_find_entry	libmpi.so.12.0.0	0.01	0.01	0.01	0.01	0.00	0.00	0.00	0.00	32	50	48	26	0.02	0.01	0.01	0.03	0.00	0.00	0.00	0.00
mkl_dft_def_ippsDFTFwd_RToCCS_32f	libmkl_def.so.2	0.01	0.01	0.01	0.01	0.00	0.00	0.00	0.00	28	34	30	37	0.02	0.03	0.02	0.02	0.00	0.00	0.00	0.00
.omp_outlined..73	libgromacs_mpi.so.9.0.0	NA	0.02	0.02	NA	NA	0.00	0.00	NA	NA	70	73	NA	NA	0.02	0.02	NA	NA	0.00	0.00	NA
void gmx::(anonymous namespace)::reduceThreadForceBuffers<float [4]>(gmx::ArrayRef<gmx::BasicVector<float> >, gmx::ArrayRef<std::unique_ptr<gmx::ThreadForceBuffer<float [4]>, std::default_delete<gmx::ThreadForceBuffer<fl...	libgromacs_mpi.so.9.0.0	0.03	NA	NA	NA	0.00	NA	NA	NA	86	NA	NA	NA	0.04	NA	NA	NA	0.01	NA	NA	NA
__kmpc_end_serialized_parallel	libiomp5.so	NA	NA	NA	0.03	NA	NA	NA	0.00	NA	NA	NA	102	NA	NA	NA	0.03	NA	NA	NA	0.00
inflate_fast	libmpi.so.12.0.0	0.01	0.01	0.01	0.01	0.00	0.00	0.00	0.00	42	45	44	43	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
MPID_Progress_completion_count_incr	libmpi.so.12.0.0	0.01	0.01	0.01	0.01	0.00	0.00	0.00	0.00	37	45	37	32	0.02	0.01	0.02	0.01	0.00	0.00	0.00	0.00
__kmp_join_call	libomp.so	NA	0.02	0.02	NA	NA	0.00	0.00	NA	NA	66	76	NA	NA	0.02	0.02	NA	NA	0.00	0.00	NA
gmx_fft_1d_real(gmx_fft, gmx_fft_direction, void, void*)	libgromacs_mpi.so.9.0.0	0.01	0.01	0.01	0.01	0.00	0.00	0.00	0.00	27	31	30	33	0.02	0.02	0.02	0.03	0.00	0.00	0.00	0.00
MPIDU_Init_shm_init	libmpi.so.12.0.0	0.01	0.01	0.01	0.01	0.00	0.00	0.00	0.00	39	54	34	34	0.00	0.01	0.00	0.00	0.00	0.00	0.00	0.00
Nbnxm::Grid::setCellIndices(int, int, Nbnxm::GridSetData, gmx::ArrayRef<Nbnxm::GridWork>, gmx::Range<int>, gmx::ArrayRef<long const>, gmx::ArrayRef<gmx::BasicVector<float> const>, int, nbnxn_atomdata_t)	libgromacs_mpi.so.9.0.0	0.01	0.01	0.01	0.01	0.00	0.00	0.00	0.00	41	39	28	30	0.02	0.02	0.01	0.02	0.00	0.00	0.00	0.00
MPIC_Irecv	libmpi.so.12.0.0	0.01	0.01	0.01	0.01	0.00	0.00	0.00	0.00	25	30	30	29	0.03	0.03	0.02	0.03	0.00	0.00	0.00	0.00
void get_cell_range<1>(float, float, Nbnxm::Grid::Dimensions const&, float, float, int, int)	libgromacs_mpi.so.9.0.0	0.03	NA	NA	NA	0.00	NA	NA	NA	91	NA	NA	NA	0.03	NA	NA	NA	0.00	NA	NA	NA
wallcycleBarrier(gmx_wallcycle*)	libgromacs_mpi.so.9.0.0	0.01	0.01	0.00	0.01	0.00	0.00	0.00	0.00	37	37	29	33	0.02	0.01	0.01	0.01	0.00	0.00	0.00	0.00
float (anonymous namespace)::idihs<(BondedKernelFlavor)0>(int, int const, t_iparams const, float const () [3], float () [4], float () [3], t_pbc const, float, float, gmx::ArrayRef<float const>, t_fcdata, t_disresdata, t_oriresdata, in...	libgromacs_mpi.so.9.0.0	0.01	0.00	0.00	0.01	0.00	0.00	0.00	0.00	26	17	19	25	0.05	0.02	0.02	0.03	0.01	0.00	0.00	0.00
mkl_dft_def_ippsDFTInv_CCSToR_32f	libmkl_def.so.2	0.01	0.01	0.01	0.01	0.00	0.00	0.00	0.00	26	28	31	26	0.03	0.02	0.01	0.03	0.00	0.00	0.00	0.00
atoms_to_constraints(gmx_domdec_t, gmx_mtop_t const&, gmx::ArrayRef<long const>, gmx::ArrayRef<gmx::ListOfLists<int> const>, int, InteractionList, std::vector<int, std::allocator<int> >*)	libgromacs_mpi.so.9.0.0	NA	0.01	0.01	0.01	NA	0.00	0.00	0.00	NA	45	33	40	NA	0.01	0.02	0.02	NA	0.00	0.00	0.00
Nbnxm::Grid::calcColumnIndices(Nbnxm::Grid::Dimensions const&, gmx::UpdateGroupsCog const, gmx::Range<int>, gmx::ArrayRef<gmx::BasicVector<float> const>, int, int const, int, int, gmx::ArrayRef<int>, gmx::ArrayRef<int>)	libgromacs_mpi.so.9.0.0	0.01	0.00	0.01	0.01	0.00	0.00	0.00	0.00	34	25	32	34	0.02	0.01	0.01	0.02	0.00	0.00	0.00	0.00
__kmp_serialized_parallel	libiomp5.so	NA	NA	NA	0.03	NA	NA	NA	0.00	NA	NA	NA	94	NA	NA	NA	0.03	NA	NA	NA	0.00
_int_malloc	libc.so.6	0.02	0.00	0.00	0.00	0.00	0.00	0.00	0.00	76	15	12	12	0.02	0.00	0.00	0.00	0.00	0.00	0.00	0.00
__GI___libc_free	libc.so.6	0.01	0.01	0.01	0.00	0.00	0.00	0.00	0.00	37	31	39	20	0.01	0.01	0.01	0.00	0.00	0.00	0.00	0.00
gmx_fft_many_1d(gmx_fft, gmx_fft_direction, void, void*)	libgromacs_mpi.so.9.0.0	0.01	0.00	0.00	0.01	0.00	0.00	0.00	0.00	34	17	22	21	0.03	0.02	0.02	0.02	0.00	0.00	0.00	0.00
mkl_dft_def_transfer_ipp_mkl_error	libmkl_def.so.2	0.01	0.00	0.01	0.01	0.00	0.00	0.00	0.00	29	20	32	18	0.02	0.01	0.02	0.03	0.00	0.00	0.00	0.00
_dl_relocate_object	ld-linux-x86-64.so.2	0.00	0.01	0.01	0.00	0.00	0.00	0.00	0.00	21	41	37	18	0.00	0.01	0.01	0.01	0.00	0.00	0.00	0.00
void get_cell_range<0>(float, float, Nbnxm::Grid::Dimensions const&, float, float, int, int)	libgromacs_mpi.so.9.0.0	0.02	NA	NA	NA	0.00	NA	NA	NA	81	NA	NA	NA	0.03	NA	NA	NA	0.00	NA	NA	NA
clearDDStateIndices(gmx_domdec_t*, bool)	libgromacs_mpi.so.9.0.0	0.02	NA	NA	NA	0.00	NA	NA	NA	71	NA	NA	NA	0.03	NA	NA	NA	0.00	NA	NA	NA
MPI_Alltoall	libmpi.so.12.0.0	0.00	0.01	0.01	0.01	0.00	0.00	0.00	0.00	16	25	26	22	0.02	0.03	0.02	0.03	0.00	0.00	0.00	0.00
MPI_Send	libmpi.so.12.0.0	0.01	0.00	0.00	0.01	0.00	0.00	0.00	0.00	27	21	23	29	0.01	0.01	0.02	0.01	0.00	0.00	0.00	0.00
atan2f	libm.so.6	0.01	0.01	NA	NA	0.00	0.00	NA	NA	41	42	NA	NA	0.03	0.02	NA	NA	0.00	0.00	NA	NA
pme_receive_force_ener(t_forcerec, t_commrec const, gmx::ForceWithVirial, gmx_enerdata_t, bool, bool, gmx_wallcycle*)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.01	0.00	0.00	0.00	0.00	24	24	21	33	0.00	0.01	0.01	0.01	0.00	0.00	0.00	0.00
nonbonded_verlet_t::dispatchNonbondedKernel(gmx::InteractionLocality, interaction_const_t const&, gmx::StepWorkload const&, int, gmx::ArrayRef<gmx::BasicVector<float> const>, gmx::ArrayRef<float>, gmx::ArrayRef<float>, t_nrn...	libgromacs_mpi.so.9.0.0	0.01	0.00	0.00	0.00	0.00	0.00	0.00	0.00	32	26	23	19	0.01	0.01	0.01	0.01	0.00	0.00	0.00	0.00
dd_sendrecv2_rvec(gmx_domdec_t const, int, float () [3], int, float () [3], int, float () [3], int, float (*) [3], int)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.01	0.01	0.00	0.00	0.00	0.00	20	24	29	22	0.02	0.01	0.01	0.02	0.00	0.00	0.00	0.00
void std::vector<int, std::allocator<int> >::_M_range_insert<gmx::ArrayRefIter<int const> >(__gnu_cxx::__normal_iterator<int*, std::vector<int, std::allocator<int> > >, gmx::ArrayRefIter<int const>, gmx::Arra...	libgromacs_mpi.so.9.0.0	NA	0.01	0.01	0.01	NA	0.00	0.00	0.00	NA	35	35	28	NA	0.01	0.01	0.02	NA	0.00	0.00	0.00
nral_rt(int)	libgromacs_mpi.so.9.0.0	0.00	0.01	0.00	0.00	0.00	0.00	0.00	0.00	22	35	18	20	0.01	0.01	0.01	0.00	0.00	0.00	0.00	0.00
MPIDI_coll_invoke	libmpi.so.12.0.0	0.00	0.00	0.00	0.01	0.00	0.00	0.00	0.00	23	21	24	26	0.01	0.01	0.01	0.01	0.00	0.00	0.00	0.00
nonbonded_verlet_t::convertCoordinates(gmx::AtomLocality, gmx::ArrayRef<gmx::BasicVector<float> const>)	libgromacs_mpi.so.9.0.0	0.01	0.01	0.00	0.00	0.00	0.00	0.00	0.00	32	27	22	14	0.01	0.02	0.01	0.01	0.00	0.00	0.00	0.00
dd_redistribute_cg(_IO_FILE, long, gmx_domdec_t, int, t_state, t_forcerec, t_nrnb, int*)	libgromacs_mpi.so.9.0.0	0.01	0.00	0.00	0.00	0.00	0.00	0.00	0.00	31	21	20	17	0.02	0.01	0.01	0.01	0.00	0.00	0.00	0.00
__libm_acosf_z0	binary	NA	NA	NA	0.02	NA	NA	NA	0.00	NA	NA	NA	54	NA	NA	NA	0.04	NA	NA	NA	0.00
alci::CpuIdRawData::CpuIdRawData()	libalm.so	NA	NA	0.02	NA	NA	NA	0.00	NA	NA	NA	110	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
__kmp_join_call	libiomp5.so	NA	NA	NA	0.02	NA	NA	NA	0.00	NA	NA	NA	69	NA	NA	NA	0.02	NA	NA	NA	0.00
MPIR_Alltoall_intra_scattered_impl	libmpi.so.12.0.0	0.00	0.00	0.00	0.01	0.00	0.00	0.00	0.00	21	19	18	21	0.02	0.01	0.02	0.02	0.00	0.00	0.00	0.00
std::enable_if<(((BondedKernelFlavor)2)!=((BondedKernelFlavor)0))\|\|(!(1)), float>::type (anonymous namespace)::rbdihs<(BondedKernelFlavor)2>(int, int const, t_iparams const, float const () [3], float () [4], float () [3], t_pbc const, flo...	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.01	0.00	0.00	0.00	0.00	16	11	16	20	0.02	0.02	0.02	0.03	0.00	0.00	0.00	0.00
gmx_fft_many_1d_real(gmx_fft, gmx_fft_direction, void, void*)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	22	16	23	20	0.01	0.01	0.02	0.01	0.00	0.00	0.00	0.00
std::pair<std::__detail::_Node_iterator<std::pair<AtomNonbondedAndKineticProperties const, int>, false, false>, bool> std::_Hashtable<AtomNonbondedAndKineticProperties, std::pair<AtomNonbondedAndKineticProperties const, int>, std...	libgromacs_mpi.so.9.0.0	NA	NA	NA	0.02	NA	NA	NA	0.00	NA	NA	NA	65	NA	NA	NA	0.02	NA	NA	NA	0.00
MPIC_Waitall	libmpi.so.12.0.0	0.01	0.00	0.00	0.00	0.00	0.00	0.00	0.00	21	19	23	18	0.02	0.01	0.01	0.01	0.00	0.00	0.00	0.00
atomInMolblockFromGlobalAtomnr(gmx::ArrayRef<MolblockIndices const>, int)	libgromacs_mpi.so.9.0.0	0.02	NA	NA	NA	0.00	NA	NA	NA	62	NA	NA	NA	0.02	NA	NA	NA	0.00	NA	NA	NA
MPIDIG_get_context_index	libmpi.so.12.0.0	0.00	0.00	0.00	0.01	0.00	0.00	0.00	0.00	20	17	21	20	0.01	0.00	0.01	0.02	0.00	0.00	0.00	0.00
calcBondedForces(InteractionDefinitions const&, bonded_threading_t, float const () [3], t_forcerec const, t_pbc const, float () [3], gmx_enerdata_t, t_nrnb*, gmx::ArrayRef<float const>, gmx::ArrayRef<float>, gmx::ArrayRef<float con...	libgromacs_mpi.so.9.0.0	0.02	NA	NA	NA	0.00	NA	NA	NA	55	NA	NA	NA	0.02	NA	NA	NA	0.00	NA	NA	NA
walk_out(int, int, int, int, int, gmx::ArrayRef<int const>, gmx::ArrayRef<int const>, gmx::ListOfLists<int> const&, gmx_ga2la_t const&, bool, gmx_domdec_constraints_t, gmx_domdec_specat_comm_t, InteractionList*, std::vector<i...	libgromacs_mpi.so.9.0.0	0.02	NA	NA	NA	0.00	NA	NA	NA	50	NA	NA	NA	0.03	NA	NA	NA	0.00	NA	NA	NA
ddReopenBalanceRegionCpu(gmx_domdec_t const*)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	18	23	20	17	0.00	0.01	0.01	0.01	0.00	0.00	0.00	0.00
sum_forces(gmx::ArrayRef<gmx::BasicVector<float> >, gmx::ArrayRef<gmx::BasicVector<float> const>) [clone .extracted]	libgromacs_mpi.so.9.0.0	NA	NA	NA	0.02	NA	NA	NA	0.00	NA	NA	NA	56	NA	NA	NA	0.03	NA	NA	NA	0.00
amd_cosf_zn4	libalm.so	NA	NA	0.01	NA	NA	NA	0.00	NA	NA	NA	52	NA	NA	NA	0.03	NA	NA	NA	0.00	NA
(anonymous namespace)::calc_one_bond(int, int, InteractionDefinitions const&, gmx::ArrayRef<int const>, int, WorkDivision const&, float const () [3], float () [4], float () [3], t_forcerec const, t_pbc const, gmx_grppairener_t, t_nrnb*,...	libgromacs_mpi.so.9.0.0	NA	0.01	0.00	0.01	NA	0.00	0.00	0.00	NA	30	19	24	NA	0.01	0.01	0.02	NA	0.00	0.00	0.00
CpuPpLongRangeNonbondeds::calculate(gmx_pme_t, t_commrec const, gmx::ArrayRef<gmx::BasicVector<float> const>, gmx::ForceWithVirial, gmx_enerdata_t, float const (*) [3], gmx::ArrayRef<float const>, gmx::ArrayRef<gmx::BasicVector<...	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.01	0.00	0.00	0.00	0.00	9	14	26	26	0.00	0.01	0.00	0.01	0.00	0.00	0.00	0.00
ListedForces::calculate(gmx_wallcycle, float const () [3], t_commrec const, gmx_multisim_t const, gmx::ArrayRefWithPadding<gmx::BasicVector<float> const>, gmx::ArrayRef<gmx::BasicVector<float> const>, t_fcdata, history_t const...	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	16	22	20	18	0.00	0.00	0.01	0.01	0.00	0.00	0.00	0.00
_dl_addr	libc.so.6	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	17	19	22	19	0.00	0.00	0.00	0.01	0.00	0.00	0.00	0.00
unlink_chunk.constprop.0	libc.so.6	0.01	0.00	0.00	0.00	0.00	0.00	0.00	0.00	56	1	3	1	0.02	0.00	0.00	0.00	0.00	0.00	0.00	0.00
MPIDIG_enqueue_unexp	libmpi.so.12.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	19	20	19	13	0.01	0.01	0.01	0.02	0.00	0.00	0.00	0.00
GOMP_parallel	libgomp.so.1.0.0	0.01	NA	NA	NA	0.00	NA	NA	NA	57	NA	NA	NA	0.02	NA	NA	NA	0.00	NA	NA	NA
dd_make_local_constraints(gmx_domdec_t, int, gmx_mtop_t const&, gmx::ArrayRef<long const>, gmx::Constraints, int, gmx::ArrayRef<InteractionList>) [clone .extracted]	libgromacs_mpi.so.9.0.0	NA	NA	NA	0.01	NA	NA	NA	0.00	NA	NA	NA	48	NA	NA	NA	0.03	NA	NA	NA	0.00
__kmpc_fork_call	libiomp5.so	NA	NA	NA	0.01	NA	NA	NA	0.00	NA	NA	NA	54	NA	NA	NA	0.02	NA	NA	NA	0.00
dd_make_local_constraints(gmx_domdec_t, int, gmx_mtop_t const&, gmx::ArrayRef<long const>, gmx::Constraints, int, gmx::ArrayRef<InteractionList>) [clone ._omp_fn.0]	libgromacs_mpi.so.9.0.0	0.01	NA	NA	NA	0.00	NA	NA	NA	54	NA	NA	NA	0.02	NA	NA	NA	0.00	NA	NA	NA
gmx::ListOfLists<int>::pushBack(gmx::ArrayRef<int const>)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	21	17	18	12	0.01	0.01	0.01	0.02	0.00	0.00	0.00	0.00
MPIDI_coll_select	libmpi.so.12.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	14	18	17	18	0.00	0.01	0.01	0.01	0.00	0.00	0.00	0.00
PmeAtomComm::setNumAtoms(int)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	19	11	18	13	0.02	0.00	0.02	0.01	0.00	0.00	0.00	0.00
__kmpc_barrier	libomp.so	NA	0.01	0.01	NA	NA	0.00	0.00	NA	NA	30	32	NA	NA	0.02	0.02	NA	NA	0.00	0.00	NA
gmx::constrain_lincs(bool, t_inputrec const&, long, gmx::Lincs, gmx::ArrayRef<float const>, t_commrec const, gmx_multisim_t const*, gmx::ArrayRefWithPadding<gmx::BasicVector<float> const>, gmx::ArrayRefWithPadding<gmx::BasicVecto...	libgromacs_mpi.so.9.0.0	0.01	0.00	0.00	0.00	0.00	0.00	0.00	0.00	28	12	10	13	0.01	0.01	0.01	0.01	0.00	0.00	0.00	0.00
.omp_outlined.#0x69ee50	libgromacs_mpi.so.9.0.0	NA	NA	0.01	NA	NA	NA	0.00	NA	NA	NA	59	NA	NA	NA	0.02	NA	NA	NA	0.00	NA
gmx::Update::Impl::finish_update(t_inputrec const&, bool, int, gmx::ArrayRef<unsigned short const>, t_state, gmx_wallcycle, bool)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	19	15	10	18	0.01	0.00	0.01	0.00	0.00	0.00	0.00	0.00
gmx::CpuInfo::detect()	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	18	21	16	12	0.00	0.01	0.00	0.00	0.00	0.00	0.00	0.00
void ddSendrecv<gmx::BasicVector<float> >(gmx_domdec_t const*, int, int, gmx::ArrayRef<gmx::BasicVector<float> >, gmx::ArrayRef<gmx::BasicVector<float> >)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	15	13	21	15	0.00	0.01	0.01	0.01	0.00	0.00	0.00	0.00
__kmp_get_global_thread_id_reg	libomp.so	NA	0.01	0.01	NA	NA	0.00	0.00	NA	NA	26	40	NA	NA	0.01	0.01	NA	NA	0.00	0.00	NA
.omp_outlined.#0x69eab0	libgromacs_mpi.so.9.0.0	NA	0.01	NA	NA	NA	0.00	NA	NA	NA	53	NA	NA	NA	0.02	NA	NA	NA	0.00	NA	NA
gmx_pme_send_coordinates(t_forcerec, t_commrec const, float const () [3], gmx::ArrayRef<gmx::BasicVector<float> const>, float, float, bool, long, bool, bool, bool, bool, GpuEventSynchronizer, bool, gmx_wallcycle*)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	14	13	14	18	0.01	0.01	0.00	0.01	0.00	0.00	0.00	0.00
.omp_outlined..3#0xc01c30	libgromacs_mpi.so.9.0.0	NA	0.01	NA	NA	NA	0.00	NA	NA	NA	41	NA	NA	NA	0.03	NA	NA	NA	0.00	NA	NA
.omp_outlined..29	libgromacs_mpi.so.9.0.0	NA	0.01	0.01	NA	NA	0.00	0.00	NA	NA	30	32	NA	NA	0.01	0.01	NA	NA	0.00	0.00	NA
gomp_team_start	libgomp.so.1.0.0	0.01	NA	NA	NA	0.00	NA	NA	NA	51	NA	NA	NA	0.02	NA	NA	NA	0.00	NA	NA	NA
adler32	libmpi.so.12.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	13	17	18	14	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
__kmpc_for_static_init_4	libomp.so	NA	0.01	0.01	NA	NA	0.00	0.00	NA	NA	32	33	NA	NA	0.01	0.00	NA	NA	0.00	0.00	NA
__kmp_push_num_threads	libomp.so	NA	0.01	0.01	NA	NA	0.00	0.00	NA	NA	31	29	NA	NA	0.01	0.01	NA	NA	0.00	0.00	NA
dd_make_local_constraints(gmx_domdec_t, int, gmx_mtop_t const&, gmx::ArrayRef<long const>, gmx::Constraints, int, gmx::ArrayRef<InteractionList>)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	13	18	13	14	0.01	0.00	0.00	0.01	0.00	0.00	0.00	0.00
unwrap_periodic_pmegrid(gmx_pme_t, float) [clone ._omp_fn.1]	libgromacs_mpi.so.9.0.0	0.01	NA	NA	NA	0.00	NA	NA	NA	37	NA	NA	NA	0.03	NA	NA	NA	0.00	NA	NA	NA
_INTERNALae4d1d49::rml::internal::internalPoolMalloc(_INTERNALae4d1d49::rml::internal::MemoryPool*, unsigned long)	libiomp5.so	NA	NA	NA	0.01	NA	NA	NA	0.00	NA	NA	NA	46	NA	NA	NA	0.01	NA	NA	NA	0.00
impi_malloc	libmpi.so.12.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	21	16	11	10	0.00	0.01	0.00	0.00	0.00	0.00	0.00	0.00
DDBalanceRegionHandler::closeRegionCpuImpl() const	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	15	12	18	13	0.01	0.00	0.01	0.00	0.00	0.00	0.00	0.00
__kmp_invoke_microtask	libiomp5.so	NA	NA	NA	0.01	NA	NA	NA	0.00	NA	NA	NA	44	NA	NA	NA	0.02	NA	NA	NA	0.00
__kmp_invoke_microtask	libomp.so	NA	0.00	0.01	NA	NA	0.00	0.00	NA	NA	26	35	NA	NA	0.01	0.01	NA	NA	0.00	0.00	NA
gmx::set_lincs(InteractionDefinitions const&, int, gmx::ArrayRef<float const>, float, bool, t_commrec const, gmx::Lincs)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	13	15	16	11	0.01	0.00	0.01	0.00	0.00	0.00	0.00	0.00
.omp_outlined..3#0xc03c80	libgromacs_mpi.so.9.0.0	NA	NA	0.01	NA	NA	NA	0.00	NA	NA	NA	42	NA	NA	NA	0.02	NA	NA	NA	0.00	NA
calcBondedForces(InteractionDefinitions const&, bonded_threading_t, float const () [3], t_forcerec const, t_pbc const, float () [3], gmx_enerdata_t, t_nrnb*, gmx::ArrayRef<float const>, gmx::ArrayRef<float>, gmx::ArrayRef<float con...	libgromacs_mpi.so.9.0.0	NA	NA	NA	0.01	NA	NA	NA	0.00	NA	NA	NA	38	NA	NA	NA	0.02	NA	NA	NA	0.00
.omp_outlined.#0xbe7d90	libgromacs_mpi.so.9.0.0	NA	NA	0.01	NA	NA	NA	0.00	NA	NA	NA	47	NA	NA	NA	0.02	NA	NA	NA	0.00	NA
nbnxn_atomdata_copy_shiftvec(bool, gmx::ArrayRef<gmx::BasicVector<float> >, nbnxn_atomdata_t*)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	10	21	10	10	0.01	0.01	0.01	0.01	0.00	0.00	0.00	0.00
MPIDI_CH4_check_container	libmpi.so.12.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	12	8	15	13	0.01	0.01	0.01	0.02	0.00	0.00	0.00	0.00
__GI___sched_setaffinity_new	libc.so.6	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	17	10	15	10	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
nonbonded_verlet_t::atomdata_add_nbat_f_to_f(gmx::AtomLocality, gmx::ArrayRef<gmx::BasicVector<float> >)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	13	6	17	14	0.00	0.00	0.00	0.01	0.00	0.00	0.00	0.00
atoms_to_constraints(gmx_domdec_t, gmx_mtop_t const&, gmx::ArrayRef<long const>, gmx::ArrayRef<gmx::ListOfLists<int> const>, int, InteractionList, std::vector<int, std::allocator<int> >*) [clone .isra.0]	libgromacs_mpi.so.9.0.0	0.01	NA	NA	NA	0.00	NA	NA	NA	39	NA	NA	NA	0.02	NA	NA	NA	0.00	NA	NA	NA
void do_dih_fup<(BondedKernelFlavor)0>(int, int, int, int, float, float, float, float, float, float, float () [4], float () [3], t_pbc const, float const (*) [3], int, int, int)	libgromacs_mpi.so.9.0.0	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00	NA	13	14	15	NA	0.01	0.03	0.02	NA	0.00	0.00	0.00
__memcpy_avx512_unaligned_erms	libc.so.6	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	14	19	15	2	0.00	0.01	0.01	0.00	0.00	0.00	0.00	0.00
ListedForces::haveCpuListedForces(t_fcdata const&) const	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	6	10	20	13	0.00	0.00	0.00	0.02	0.00	0.00	0.00	0.00
gmx::set_lincs_matrix(gmx::Lincs*, gmx::ArrayRef<float const>, float) [clone ._omp_fn.0]	libgromacs_mpi.so.9.0.0	0.01	NA	NA	NA	0.00	NA	NA	NA	38	NA	NA	NA	0.02	NA	NA	NA	0.00	NA	NA	NA
.omp_outlined.#0x6c6780	libgromacs_mpi.so.9.0.0	NA	NA	0.01	NA	NA	NA	0.00	NA	NA	NA	44	NA	NA	NA	0.02	NA	NA	NA	0.00	NA
__kmpc_for_static_init_4	libiomp5.so	NA	NA	NA	0.01	NA	NA	NA	0.00	NA	NA	NA	41	NA	NA	NA	0.01	NA	NA	NA	0.00
int make_bondeds_zone<false>(gmx_reverse_top_t const&, gmx::ArrayRef<int const>, gmx_ga2la_t const&, gmx_domdec_zones_t const&, std::vector<gmx_molblock_t, std::allocator<gmx_molblock_t> > const&, bool, int const*, b...	libgromacs_mpi.so.9.0.0	0.01	NA	NA	NA	0.00	NA	NA	NA	40	NA	NA	NA	0.01	NA	NA	NA	0.00	NA	NA	NA
MPIDI_OFI_coll_select	libmpi.so.12.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	19	5	11	10	0.01	0.00	0.00	0.01	0.00	0.00	0.00	0.00
unwrap_periodic_pmegrid(gmx_pme_t, float) [clone .extracted]	libgromacs_mpi.so.9.0.0	NA	NA	NA	0.01	NA	NA	NA	0.00	NA	NA	NA	30	NA	NA	NA	0.03	NA	NA	NA	0.00
gomp_team_end	libgomp.so.1.0.0	0.01	NA	NA	NA	0.00	NA	NA	NA	39	NA	NA	NA	0.01	NA	NA	NA	0.00	NA	NA	NA
.omp_outlined..49	libgromacs_mpi.so.9.0.0	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA	21	22	NA	NA	0.02	0.01	NA	NA	0.00	0.00	NA
gmx::set_lincs_matrix(gmx::Lincs*, gmx::ArrayRef<float const>, float) [clone .extracted]	libgromacs_mpi.so.9.0.0	NA	NA	NA	0.01	NA	NA	NA	0.00	NA	NA	NA	31	NA	NA	NA	0.03	NA	NA	NA	0.00
gmx::constr_recur(gmx::ListOfLists<int> const&, std::array<InteractionList, 94ul> const&, gmx::ArrayRef<t_iparams const>, bool, int, int, int, gmx::ArrayRef<int>, float, float, float, int) [clone .constprop.0]	libgromacs_mpi.so.9.0.0	0.01	NA	NA	NA	0.00	NA	NA	NA	44	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
setup_dd_communication(gmx_domdec_t, float () [3], gmx_ddbox_t, t_forcerec, t_state*)	libgromacs_mpi.so.9.0.0	0.01	NA	NA	NA	0.00	NA	NA	NA	37	NA	NA	NA	0.02	NA	NA	NA	0.00	NA	NA	NA
calculateSimpleBond(int, int, int const, t_iparams const, float const () [3], float () [4], float () [3], t_pbc const, float, float, gmx::ArrayRef<float const>, t_fcdata, t_disresdata, t_oriresdata, int*, BondedKernelFlavor)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	17	14	10	4	0.00	0.00	0.01	0.02	0.00	0.00	0.00	0.00
MPID_Progress_test_impl	libmpi.so.12.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	11	11	16	8	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
reset_enerdata(gmx_enerdata_t*)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	7	9	4	19	0.01	0.01	0.02	0.01	0.00	0.00	0.00	0.00
MPID_Progress_yield	libmpi.so.12.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	9	16	13	7	0.00	0.00	0.00	0.02	0.00	0.00	0.00	0.00
gomp_new_team	libgomp.so.1.0.0	0.01	NA	NA	NA	0.00	NA	NA	NA	39	NA	NA	NA	0.01	NA	NA	NA	0.00	NA	NA	NA
gmx::makeAtomsToConstraintsList(int, gmx::ArrayRef<InteractionList const>, gmx::ArrayRef<t_iparams const>, gmx::FlexibleConstraintTreatment)	libgromacs_mpi.so.9.0.0	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00	NA	15	20	8	NA	0.01	0.00	0.01	NA	0.00	0.00	0.00
gmx::InMemoryDeserializer::doUChar(unsigned char*)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	10	13	11	9	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
gmx::set_lincs(InteractionDefinitions const&, int, gmx::ArrayRef<float const>, float, bool, t_commrec const, gmx::Lincs) [clone .extracted]	libgromacs_mpi.so.9.0.0	NA	NA	NA	0.01	NA	NA	NA	0.00	NA	NA	NA	29	NA	NA	NA	0.03	NA	NA	NA	0.00
make_reverse_ilist(std::array<InteractionList, 94ul> const&, t_atoms const, ReverseTopOptions const&, AtomLinkRule, reverse_ilist_t)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	16	10	6	9	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
int __kmp_barrier_template<false>(barrier_type, int, int, unsigned long, void, void ()(void, void)) [clone .isra.33]	libomp.so	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA	21	23	NA	NA	0.00	0.01	NA	NA	0.00	0.00	NA
dd_redistribute_cg(_IO_FILE, long, gmx_domdec_t, int, t_state, t_forcerec, t_nrnb, int*) [clone .extracted]	libgromacs_mpi.so.9.0.0	NA	NA	NA	0.01	NA	NA	NA	0.00	NA	NA	NA	29	NA	NA	NA	0.02	NA	NA	NA	0.00
MPIR_Wait_impl	libmpi.so.12.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	13	6	12	9	0.00	0.00	0.01	0.00	0.00	0.00	0.00	0.00
gmx::set_lincs(InteractionDefinitions const&, int, gmx::ArrayRef<float const>, float, bool, t_commrec const, gmx::Lincs) [clone ._omp_fn.0]	libgromacs_mpi.so.9.0.0	0.01	NA	NA	NA	0.00	NA	NA	NA	35	NA	NA	NA	0.01	NA	NA	NA	0.00	NA	NA	NA
__kmp_get_global_thread_id_reg	libiomp5.so	NA	NA	NA	0.01	NA	NA	NA	0.00	NA	NA	NA	31	NA	NA	NA	0.02	NA	NA	NA	0.00
.omp_outlined.#0xb02120	libgromacs_mpi.so.9.0.0	NA	NA	0.01	NA	NA	NA	0.00	NA	NA	NA	36	NA	NA	NA	0.01	NA	NA	NA	0.00	NA
__kmpc_barrier	libiomp5.so	NA	NA	NA	0.01	NA	NA	NA	0.00	NA	NA	NA	29	NA	NA	NA	0.02	NA	NA	NA	0.00
gmx_reverse_top_t::hasIntermolecularInteractions() const	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	7	15	7	9	0.00	0.01	0.00	0.00	0.00	0.00	0.00	0.00
__strncmp_evex	libc.so.6	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	8	9	14	8	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
global_stat(gmx_global_stat const&, t_commrec const, gmx_enerdata_t, float () [3], float () [3], t_inputrec const&, gmx_ekindata_t, t_vcm, gmx::ArrayRef<float>, bool, int, long, gmx::ObservablesReducer*)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	7	10	8	12	0.00	0.00	0.01	0.00	0.00	0.00	0.00	0.00
.omp_outlined.#0xbe5d40	libgromacs_mpi.so.9.0.0	NA	0.01	NA	NA	NA	0.00	NA	NA	NA	34	NA	NA	NA	0.02	NA	NA	NA	0.00	NA	NA
gmx::constrain_coordinates(gmx::Constraints, bool, bool, long, t_state, gmx::ArrayRefWithPadding<gmx::BasicVector<float> >, float, bool, float () [3])	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	4	11	15	7	0.00	0.00	0.01	0.02	0.00	0.00	0.00	0.00
scalable_aligned_free	libiomp5.so	NA	NA	NA	0.01	NA	NA	NA	0.00	NA	NA	NA	31	NA	NA	NA	0.01	NA	NA	NA	0.00
.omp_outlined.#0x6c63e0	libgromacs_mpi.so.9.0.0	NA	0.01	NA	NA	NA	0.00	NA	NA	NA	35	NA	NA	NA	0.01	NA	NA	NA	0.00	NA	NA
__GI___printf_fp_l	libc.so.6	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	1	1	1	2	0.00	0.00	0.00	0.20	0.00	0.00	0.00	0.02
compute_globals(gmx_global_stat, t_commrec, t_inputrec const, t_forcerec, gmx_ekindata_t, gmx::ArrayRef<gmx::BasicVector<float> const>, gmx::ArrayRef<gmx::BasicVector<float> const>, float const () [3], t_mdatoms const*, t_nrnb...	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	6	8	9	11	0.00	0.00	0.01	0.00	0.00	0.00	0.00	0.00
gmx_omp_get_thread_num()	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	8	11	8	9	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
dd_force_flop_stop(gmx_domdec_t, t_nrnb)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	10	12	6	5	0.01	0.01	0.00	0.00	0.00	0.00	0.00	0.00
std::vector<nbnxn_cj_t, std::allocator<nbnxn_cj_t> >::_M_default_append(unsigned long)	libgromacs_mpi.so.9.0.0	0.01	NA	NA	NA	0.00	NA	NA	NA	28	NA	NA	NA	0.01	NA	NA	NA	0.00	NA	NA	NA
__kmpc_fork_call	libomp.so	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA	12	24	NA	NA	0.01	0.01	NA	NA	0.00	0.00	NA
.omp_outlined.#0xb00250	libgromacs_mpi.so.9.0.0	NA	0.01	NA	NA	NA	0.00	NA	NA	NA	30	NA	NA	NA	0.01	NA	NA	NA	0.00	NA	NA
__kmp_push_num_threads	libiomp5.so	NA	NA	NA	0.01	NA	NA	NA	0.00	NA	NA	NA	28	NA	NA	NA	0.01	NA	NA	NA	0.00
_int_memalign	libc.so.6	0.01	NA	NA	NA	0.00	NA	NA	NA	27	NA	NA	NA	0.01	NA	NA	NA	0.00	NA	NA	NA
std::vector<int, std::allocator<int> >::_M_default_append(unsigned long)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	NA	0.00	0.00	0.00	NA	10	9	14	NA	0.01	0.00	0.00	NA	0.00	0.00	0.00	NA
dd_redistribute_cg(_IO_FILE, long, gmx_domdec_t, int, t_state, t_forcerec, t_nrnb, int*) [clone ._omp_fn.0]	libgromacs_mpi.so.9.0.0	0.01	NA	NA	NA	0.00	NA	NA	NA	27	NA	NA	NA	0.01	NA	NA	NA	0.00	NA	NA	NA
mkl_dft_def_ownscDftInv_Fact4_32fc@plt	libmkl_def.so.2	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	5	11	7	9	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
gmx::ThreadedForceBuffer<float [4]>::reduce(gmx::ForceWithShiftForces, float, gmx_grppairener_t*, gmx::ArrayRef<float>, gmx::StepWorkload const&, int)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	8	9	4	8	0.02	0.00	0.00	0.00	0.00	0.00	0.00	0.00
DDBalanceRegionHandler::openRegionCpuImpl(DdAllowBalanceRegionReopen) const	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	7	8	5	10	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
nonbonded_verlet_t::isDynamicPruningStepCpu(long) const	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	8	4	6	11	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
MPIR_Alltoall	libmpi.so.12.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	8	6	8	7	0.00	0.00	0.01	0.00	0.00	0.00	0.00	0.00
__I_MPI__intel_fast_memcpy	libmpifort.so.12.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	9	7	6	7	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
gmx_parallel_3dfft_real_limits(gmx_parallel_3dfft, int, int, int)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	11	8	5	4	0.01	0.00	0.00	0.00	0.00	0.00	0.00	0.00
__GI_getenv	libc.so.6	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	3	15	6	6	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
gmx::InMemoryDeserializer::doFloat(float*)	libgromacs_mpi.so.9.0.0	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00	NA	9	8	9	NA	0.01	0.00	0.03	NA	0.00	0.00	0.00
__kmpc_for_static_fini	libomp.so	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA	14	18	NA	NA	0.00	0.00	NA	NA	0.00	0.00	NA
MPIU_Selection_set_coll_match_pattern	libmpi.so.12.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	5	7	4	8	0.02	0.01	0.00	0.02	0.00	0.00	0.00	0.00
gmx_pme_do(gmx_pme_t*, gmx::ArrayRef<gmx::BasicVector<float> const>, gmx::ArrayRef<gmx::BasicVector<float> >, gmx::ArrayRef<float const>, gmx::ArrayRef<float const>, gmx::ArrayRef<float const>, gmx::ArrayRef<flo...	libgromacs_mpi.so.9.0.0	NA	NA	NA	0.01	NA	NA	NA	0.00	NA	NA	NA	21	NA	NA	NA	0.02	NA	NA	NA	0.00
__kmpc_for_static_fini	libiomp5.so	NA	NA	NA	0.01	NA	NA	NA	0.00	NA	NA	NA	24	NA	NA	NA	0.01	NA	NA	NA	0.00
mkl_dft_def_ownscDftFwd_Fact4_32fc@plt	libmkl_def.so.2	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	6	4	8	9	0.00	0.00	0.01	0.00	0.00	0.00	0.00	0.00
strcmp	ld-linux-x86-64.so.2	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	3	12	8	6	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
_dl_fixup	ld-linux-x86-64.so.2	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	11	3	2	9	0.00	0.00	0.00	0.01	0.00	0.00	0.00	0.00
update_tcouple(long, t_inputrec const, t_state, gmx_ekindata_t, t_extmass const, int, gmx::ArrayRef<unsigned short const>)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	7	7	6	7	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
check_match	ld-linux-x86-64.so.2	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	6	9	9	4	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
getGroupType(SimulationGroups const&, SimulationAtomGroupType, int)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	6	8	11	3	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
MPID_Progress_idle_timer_start	libmpi.so.12.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	5	8	2	9	0.02	0.00	0.00	0.00	0.00	0.00	0.00	0.00
sum_forces(gmx::ArrayRef<gmx::BasicVector<float> >, gmx::ArrayRef<gmx::BasicVector<float> const>) [clone ._omp_fn.0]	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	22	NA	NA	NA	0.01	NA	NA	NA	0.00	NA	NA	NA
dd_cycles_add(gmx_domdec_t const*, float, int)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	6	5	7	7	0.00	0.00	0.00	0.02	0.00	0.00	0.00	0.00
_intel_fast_memcpy	binary	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	21	NA	NA	NA	0.01	NA	NA	NA	0.00
setup_bonded_threading(bonded_threading_t*, int, bool, InteractionDefinitions const&) [clone .extracted]	libgromacs_mpi.so.9.0.0	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	22	NA	NA	NA	0.01	NA	NA	NA	0.00
clearForceBuffer(nbnxn_atomdata_t*, int)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	4	10	7	5	0.00	0.00	0.01	0.00	0.00	0.00	0.00	0.00
gmx_pme_send_coeffs_coords(t_forcerec, t_commrec const, unsigned int, gmx::ArrayRef<float const>, gmx::ArrayRef<float const>, gmx::ArrayRef<float const>, gmx::ArrayRef<float const>, gmx::ArrayRef<float const>, gmx::ArrayRef&...	libgromacs_mpi.so.9.0.0	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00	NA	7	10	7	NA	0.01	0.01	0.00	NA	0.00	0.00	0.00
__vfprintf_internal	libc.so.6	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	1	3	1	2	0.00	0.11	0.00	0.11	0.00	0.02	0.00	0.01
gomp_team_barrier_wait_final	libgomp.so.1.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	20	NA	NA	NA	0.02	NA	NA	NA	0.00	NA	NA	NA
nbnxn_kernel_cpu(PairlistSet const&, Nbnxm::KernelSetup const&, nbnxn_atomdata_t, interaction_const_t const&, gmx::ArrayRef<gmx::BasicVector<float> const>, gmx::StepWorkload const&, int, float, float, gmx_wallcycle) [clone ....	libgromacs_mpi.so.9.0.0	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	20	NA	NA	NA	0.01	NA	NA	NA	0.00
__kmp_barrier	libiomp5.so	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	21	NA	NA	NA	0.01	NA	NA	NA	0.00
impi_free	libmpi.so.12.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	11	4	2	7	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
gmx_reverse_top_t::molblockIndices() const	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	3	1	12	8	0.00	0.00	0.00	0.01	0.00	0.00	0.00	0.00
do_nb_verlet(t_forcerec, interaction_const_t const, gmx_enerdata_t, gmx::StepWorkload const&, gmx::InteractionLocality, int, long, t_nrnb, gmx_wallcycle*)	libgromacs_mpi.so.9.0.0	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00	NA	5	7	12	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00
MPL_wtime_acc	libmpi.so.12.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	3	3	12	6	0.00	0.00	0.01	0.00	0.00	0.00	0.00	0.00
MPIU_Selection_get_storage	libmpi.so.12.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	7	3	9	5	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
gmx_parallel_3dfft_execute(gmx_parallel_3dfft, gmx_fft_direction, int, gmx_wallcycle)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	8	3	3	7	0.01	0.00	0.02	0.00	0.00	0.00	0.00	0.00
gmx::ForceProviders::calculateForces(gmx::ForceProviderInput const&, gmx::ForceProviderOutput*) const	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	4	3	6	10	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
_dl_runtime_resolve_xsavec	ld-linux-x86-64.so.2	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	8	2	6	7	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
nbnxn_kernel_cpu(PairlistSet const&, Nbnxm::KernelSetup const&, nbnxn_atomdata_t, interaction_const_t const&, gmx::ArrayRef<gmx::BasicVector<float> const>, gmx::StepWorkload const&, int, float, float, gmx_wallcycle) [clone ....	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	19	NA	NA	NA	0.01	NA	NA	NA	0.00	NA	NA	NA
gmx::setupStepWorkload(int, gmx::ArrayRef<gmx::MtsLevel const>, long, gmx::DomainLifetimeWorkload const&, gmx::SimulationWorkload const&)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	3	11	5	5	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
.omp_outlined.#0xbe9030	libgromacs_mpi.so.9.0.0	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	21	NA	NA	NA	0.02	NA	NA	NA	0.00	NA
__kmp_push_current_task_to_thread	libomp.so	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA	11	13	NA	NA	0.01	0.00	NA	NA	0.00	0.00	NA
calc_vir(int, float const () [3], float const () [3], float () [3], bool, float const () [3])	libgromacs_mpi.so.9.0.0	0.00	NA	0.00	0.00	0.00	NA	0.00	0.00	2	NA	1	17	0.00	NA	0.00	0.00	0.00	NA	0.00	0.00
MPIDI_GPU_request_create_hook	libmpi.so.12.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	8	10	4	1	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
set_pbc_simd(t_pbc const, float)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	5	9	6	3	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
acosf	libm.so.6	0.00	0.00	NA	NA	0.00	0.00	NA	NA	12	8	NA	NA	0.01	0.00	NA	NA	0.00	0.00	NA	NA
mdoutf_get_tng_box_output_interval(gmx_mdoutf*)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	2	5	7	7	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
std::vector<int, std::allocator<int> >::resize(unsigned long)	libgromacs_mpi.so.9.0.0	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	16	NA	NA	NA	0.02	NA	NA	NA	0.00
__kmp_hardware_timestamp	libiomp5.so	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	18	NA	NA	NA	0.00	NA	NA	NA	0.00
__kmpc_for_static_init_8	libiomp5.so	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	16	NA	NA	NA	0.01	NA	NA	NA	0.00
gmx::ImdSession::Impl::run(long, bool, float const (*) [3], gmx::ArrayRef<gmx::BasicVector<float> const>, double)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	5	4	5	6	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
minCellSizeForAtomDisplacement(gmx_mtop_t const&, t_inputrec const&, gmx::ArrayRef<gmx::RangePartitioning const>, float, ChanceTarget)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	1	8	8	4	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
.omp_outlined.#0xbe6fe0	libgromacs_mpi.so.9.0.0	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	20	NA	NA	NA	0.01	NA	NA	NA	0.00	NA	NA
inputrecDynamicBox(t_inputrec const*)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	4	8	2	4	0.00	0.01	0.00	0.02	0.00	0.00	0.00	0.00
set_zones_size(gmx_domdec_t, float () [3], gmx_ddbox_t const*, int, int, int)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	5	5	6	4	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
impi_reduce_local_11way	libmpi.so.12.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	3	9	3	5	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
gmx_reverse_top_t::interactionListForMoleculeType(int) const	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	3	2	5	9	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
setupForceOutputs(ForceHelperBuffers, gmx::ArrayRefWithPadding<gmx::BasicVector<float> >, gmx::DomainLifetimeWorkload const&, gmx::StepWorkload const&, bool, gmx_wallcycle)	libgromacs_mpi.so.9.0.0	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00	NA	5	7	7	NA	0.00	0.01	0.00	NA	0.00	0.00	0.00
dd_force_flop_start(gmx_domdec_t, t_nrnb)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	8	4	2	4	0.00	0.00	0.00	0.02	0.00	0.00	0.00	0.00
__kmp_api_omp_get_thread_num	libiomp5.so	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	15	NA	NA	NA	0.01	NA	NA	NA	0.00
PairlistSet::constructPairlists(gmx::InteractionLocality, Nbnxm::GridSet const&, gmx::ArrayRef<PairsearchWork>, nbnxn_atomdata_t, gmx::ListOfLists<int> const&, int, t_nrnb, SearchCycleCounting*)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	6	6	6	1	0.02	0.00	0.00	0.00	0.00	0.00	0.00	0.00
gmx::ImdSession::updateEnergyRecordAndSendPositionsAndEnergies(bool, long, bool)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	7	4	4	4	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
gomp_ialias_omp_get_num_threads	libgomp.so.1.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	18	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
gomp_end_task	libgomp.so.1.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	17	NA	NA	NA	0.01	NA	NA	NA	0.00	NA	NA	NA
gomp_resolve_num_threads	libgomp.so.1.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	18	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
gomp_ialias_omp_get_thread_num	libgomp.so.1.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	17	NA	NA	NA	0.01	NA	NA	NA	0.00	NA	NA	NA
gomp_fini_work_share	libgomp.so.1.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	17	NA	NA	NA	0.01	NA	NA	NA	0.00	NA	NA	NA
gmx_pme_do(gmx_pme_t*, gmx::ArrayRef<gmx::BasicVector<float> const>, gmx::ArrayRef<gmx::BasicVector<float> >, gmx::ArrayRef<float const>, gmx::ArrayRef<float const>, gmx::ArrayRef<float const>, gmx::ArrayRef<flo...	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	16	NA	NA	NA	0.02	NA	NA	NA	0.00	NA	NA	NA
gmx_parallel_3dfft_complex_limits(gmx_parallel_3dfft, int, int, int, int*)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	3	5	1	7	0.00	0.00	0.00	0.02	0.00	0.00	0.00	0.00
__kmpc_serialized_parallel	libomp.so	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA	11	10	NA	NA	0.00	0.00	NA	NA	0.00	0.00	NA
gmx::Update::finish_update(t_inputrec const&, bool, int, t_state, gmx_wallcycle, bool)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	4	1	5	8	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
gmx::set_lincs_matrix(gmx::Lincs*, gmx::ArrayRef<float const>, float)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	NA	0.00	0.00	0.00	NA	4	10	6	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00	NA
.omp_outlined.#0x5f8fd0	libgromacs_mpi.so.9.0.0	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	20	NA	NA	NA	0.01	NA	NA	NA	0.00	NA
nbnxn_atomdata_add_nbat_fshift_to_fshift(nbnxn_atomdata_t const&, gmx::ArrayRef<gmx::BasicVector<float> >)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	4	5	2	7	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
dd_clear_local_constraint_indices(gmx_domdec_t*)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	1	7	6	5	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
isMainSimMainRank(gmx_multisim_t const*, bool)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	3	5	3	7	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
gmx_get_stop_condition()	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	7	4	3	4	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
gmx_omp_nthreads_get(ModuleMultiThread)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	4	4	4	6	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
__intel_avx_rep_memset	libiomp5.so	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	16	NA	NA	NA	0.00	NA	NA	NA	0.00
__GI___pthread_getspecific	libc.so.6	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	16	NA	NA	NA	0.00	NA	NA	NA	0.00
gmx::ImdSession::run(long, bool, float const (*) [3], gmx::ArrayRef<gmx::BasicVector<float> const>, double)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	2	4	5	7	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
setup_bonded_threading(bonded_threading_t*, int, bool, InteractionDefinitions const&) [clone ._omp_fn.0]	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	16	NA	NA	NA	0.01	NA	NA	NA	0.00	NA	NA	NA
float (anonymous namespace)::idihs<(BondedKernelFlavor)2>(int, int const, t_iparams const, float const () [3], float () [4], float () [3], t_pbc const, float, float, gmx::ArrayRef<float const>, t_fcdata, t_disresdata, t_oriresdata, in...	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	5	6	2	4	0.00	0.01	0.00	0.00	0.00	0.00	0.00	0.00
__kmpc_for_static_init_8	libomp.so	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA	12	7	NA	NA	0.00	0.01	NA	NA	0.00	0.00	NA
Nbnxm::GridSet::setLocalAtomOrder()	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	4	4	3	6	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
_intel_fast_memset	binary	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	14	NA	NA	NA	0.01	NA	NA	NA	0.00
getVdwKernelType(Nbnxm::KernelType, LJCombinationRule, VanDerWaalsType, InteractionModifiers, LongRangeVdW)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	5	6	2	4	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
__kmp_pop_current_task_from_thread	libomp.so	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA	9	9	NA	NA	0.01	0.00	NA	NA	0.00	0.00	NA
gmx::constrain_lincs(bool, t_inputrec const&, long, gmx::Lincs, gmx::ArrayRef<float const>, t_commrec const, gmx_multisim_t const*, gmx::ArrayRefWithPadding<gmx::BasicVector<float> const>, gmx::ArrayRefWithPadding<gmx::BasicVecto...	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	15	NA	NA	NA	0.01	NA	NA	NA	0.00	NA	NA	NA
nbnxn_atomdata_copy_x_to_nbat_x(Nbnxm::GridSet const&, gmx::AtomLocality, float const () [3], nbnxn_atomdata_t)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	11	1	1	2	0.01	0.00	0.00	0.00	0.00	0.00	0.00	0.00
haveEnsembleTemperature(t_inputrec const&)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	5	3	5	3	0.00	0.00	0.01	0.00	0.00	0.00	0.00	0.00
MPIR_T_CVAR_REGISTER_impl	libmpi.so.12.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	1	11	5	1	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
std::vector<gmx::BasicVector<float>, gmx::DefaultInitializationAllocator<gmx::BasicVector<float>, std::allocator<gmx::BasicVector<float> > > >::_M_default_append(unsigned long)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	NA	0.00	0.00	0.00	NA	5	4	8	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00	NA
std::vector<gmx::BasicVector<float>, gmx::DefaultInitializationAllocator<gmx::BasicVector<float>, std::allocator<gmx::BasicVector<float> > > >::resize(unsigned long)	libgromacs_mpi.so.9.0.0	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	13	NA	NA	NA	0.01	NA	NA	NA	0.00
gmx::makeAtomsToConstraintsList(int, gmx::ArrayRef<InteractionList const>, gmx::ArrayRef<t_iparams const>, gmx::FlexibleConstraintTreatment) [clone .isra.0]	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	14	NA	NA	NA	0.01	NA	NA	NA	0.00	NA	NA	NA
gmx::makeMDAtoms(_IO_FILE*, gmx_mtop_t const&, t_inputrec const&, bool)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	2	4	6	4	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
gmx::erfinv(double)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	2	2	4	7	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
gmx::Update::update_coords(t_inputrec const&, long, int, bool, gmx::ArrayRef<ParticleType const>, gmx::ArrayRef<float const>, gmx::ArrayRef<gmx::BasicVector<float> const>, t_state*, gmx::ArrayRefWithPadding<gmx::BasicVector&l...	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	4	5	1	5	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
reduceForces(nbnxn_atomdata_t, gmx::AtomLocality, Nbnxm::GridSet const&, float () [3])	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	4	2	4	5	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
extract_binr(t_bin, int, int, float)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	2	6	2	5	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
add_binr(t_bin, int, float const)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	5	5	2	3	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
postProcessForces(t_commrec const, long, t_nrnb, gmx_wallcycle, float const () [3], gmx::ArrayRef<gmx::BasicVector<float> const>, gmx::ForceOutputs, float () [3], t_mdatoms const, t_forcerec const, gmx::VirtualSitesHandler*, gmx::StepWo...	libgromacs_mpi.so.9.0.0	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00	NA	4	8	3	NA	0.00	0.01	0.00	NA	0.00	0.00	0.00
calc_temp(float, float)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	3	4	4	4	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
__kmpc_push_num_threads	libomp.so	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA	9	7	NA	NA	0.00	0.00	NA	NA	0.00	0.00	NA
spread_on_grid(gmx_pme_t const, PmeAtomComm, pmegrids_t const, bool, bool, float, bool, int)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	2	2	4	5	0.00	0.00	0.00	0.02	0.00	0.00	0.00	0.00
MPIR_SUM	libmpi.so.12.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	4	4	2	4	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
do_md_trajectory_writing(_IO_FILE, t_commrec, int, t_filenm const, long, long, double, t_inputrec const, t_state, t_state, ObservablesHistory, gmx_mtop_t const&, t_forcerec, gmx_mdoutf, gmx::EnergyOutput const&, gmx_ekindata_t, gmx::Array...	libgromacs_mpi.so.9.0.0	0.00	NA	0.00	0.00	0.00	NA	0.00	0.00	3	NA	7	4	0.00	NA	0.00	0.00	0.00	NA	0.00	0.00
ListedForces::haveRestraints(t_fcdata const&) const	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	13	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
unwrap_periodic_pmegrid(gmx_pme_t, float)	libgromacs_mpi.so.9.0.0	0.00	NA	0.00	0.00	0.00	NA	0.00	0.00	7	NA	2	4	0.00	NA	0.00	0.00	0.00	NA	0.00	0.00
dd_move_x_constraints(gmx_domdec_t, float const () [3], gmx::ArrayRef<gmx::BasicVector<float> >, gmx::ArrayRef<gmx::BasicVector<float> >, bool)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	5	2	1	5	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
__kmp_push_current_task_to_thread	libiomp5.so	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	12	NA	NA	NA	0.00	NA	NA	NA	0.00
___kmp_allocate_align(unsigned long, unsigned long)	libomp.so	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA	7	8	NA	NA	0.00	0.00	NA	NA	0.00	0.00	NA
sum_ekin(t_grpopts const, gmx_ekindata_t, float*, bool, bool)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	6	1	3	3	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
do_mtop(gmx::ISerializer, gmx_mtop_t, int)	libgromacs_mpi.so.9.0.0	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00	NA	8	4	2	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00
gmx::InMemoryDeserializer::doReal(float*)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	2	3	3	4	0.00	0.00	0.02	0.00	0.00	0.00	0.00	0.00
gmx::StopConditionSignal::getSignal(_IO_FILE*)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	4	3	4	2	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
GOMP_barrier	libgomp.so.1.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	11	NA	NA	NA	0.01	NA	NA	NA	0.00	NA	NA	NA
gmx::makeConstArrayRef(std::vector<gmx::BoolType, std::allocator<gmx::BoolType> > const&)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	5	3	4	1	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
__kmpc_global_thread_num	libomp.so	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA	8	6	NA	NA	0.00	0.00	NA	NA	0.00	0.00	NA
gmx::Update::Impl::update_coords(t_inputrec const&, long, int, bool, gmx::ArrayRef<ParticleType const>, gmx::ArrayRef<float const>, gmx::ArrayRef<gmx::BasicVector<float> const>, t_state*, gmx::ArrayRefWithPadding<gmx::BasicVe...	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	5	1	1	4	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
__libm_cos_z0	binary	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	11	NA	NA	NA	0.00	NA	NA	NA	0.00
gmx::constrain_lincs(bool, t_inputrec const&, long, gmx::Lincs, gmx::ArrayRef<float const>, t_commrec const, gmx_multisim_t const*, gmx::ArrayRefWithPadding<gmx::BasicVector<float> const>, gmx::ArrayRefWithPadding<gmx::BasicVecto...	libgromacs_mpi.so.9.0.0	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	11	NA	NA	NA	0.00	NA	NA	NA	0.00
std::vector<int, gmx::DefaultInitializationAllocator<int, std::allocator<int> > >::resize(unsigned long)	libgromacs_mpi.so.9.0.0	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	9	NA	NA	NA	0.02	NA	NA	NA	0.00
__vfscanf_internal	libc.so.6	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00	NA	8	2	3	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00
MPID_Progress_start	libmpi.so.12.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	3	1	4	4	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
std::_Function_handler<gmx::StopSignal (), gmx::StopHandlerBuilder::getStopHandlerMD(gmx::compat::not_null<gmx::SimulationSignal>, bool, bool, int, bool, int, float, bool, _IO_FILE, long const&, bool const&, gmx_walltime_accounting*)::{l...	libgromacs_mpi.so.9.0.0	0.00	NA	NA	0.00	0.00	NA	NA	0.00	7	NA	NA	4	0.00	NA	NA	0.00	0.00	NA	NA	0.00
nrnbIndex(int)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	3	2	5	2	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
gomp_team_barrier_wait	libgomp.so.1.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	11	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
computeSpecialForces(_IO_FILE, t_commrec const, t_inputrec const&, gmx::Awh, gmx_enfrot, gmx::ImdSession, pull_t, long, double, gmx_wallcycle, gmx::ForceProviders, float const (*) [3], gmx::ArrayRef<gmx::BasicVector<float> const>, t...	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	11	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
mkl_serv_verbose_mode@plt	libmkl_intel_lp64.so.2	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	2	2	1	5	0.00	0.00	0.00	0.02	0.00	0.00	0.00	0.00
__kmp_resume_if_soft_paused	libiomp5.so	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	10	NA	NA	NA	0.00	NA	NA	NA	0.00
MPIC_Sendrecv	libmpi.so.12.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	2	2	7	1	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
mk_mshift(_IO_FILE, t_graph, PbcType, float const () [3], float const () [3])	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	1	1	1	1	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
std::vector<gmx::BasicVector<float>, gmx::Allocator<gmx::BasicVector<float>, gmx::HostAllocationPolicy> >::_M_fill_insert(__gnu_cxx::__normal_iterator<gmx::BasicVector<float>*, std::vector<gmx::BasicVector<float>, ...	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	5	2	2	2	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
dd_get_constraint_range(gmx_domdec_t const&, int, int)	libgromacs_mpi.so.9.0.0	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00	NA	2	4	5	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00
MPIR_Comm_create	libmpi.so.12.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	4	2	3	2	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
gmx::CheckpointHandler::decideIfCheckpointingThisStepImpl(bool, bool, bool)	libgromacs_mpi.so.9.0.0	0.00	0.00	NA	0.00	0.00	0.00	NA	0.00	2	6	NA	3	0.00	0.00	NA	0.00	0.00	0.00	NA	0.00
Nbnxm::generateAndFill2DGrid(Nbnxm::Grid, gmx::ArrayRef<Nbnxm::GridWork>, std::vector<int, gmx::Allocator<int, gmx::HostAllocationPolicy> >, float const, float const, gmx::UpdateGroupsCog const, gmx::Range<int>, float, float, ...	libgromacs_mpi.so.9.0.0	0.00	0.00	NA	0.00	0.00	0.00	NA	0.00	5	1	NA	4	0.00	0.00	NA	0.00	0.00	0.00	NA	0.00
__kmp_resume_if_soft_paused	libomp.so	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA	4	8	NA	NA	0.00	0.00	NA	NA	0.00	0.00	NA
MPID_Progress_idle_timer_stop	libmpi.so.12.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	2	5	3	1	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
float gmx::GammaDistribution<float>::operator()<gmx::ThreeFry2x64<64u> >(gmx::ThreeFry2x64<64u>&, gmx::GammaDistribution<float>::param_type const&)	libgromacs_mpi.so.9.0.0	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00	NA	6	3	2	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00
mkl_dft_def_transfer_ipp_mkl_error@plt	libmkl_def.so.2	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	4	2	1	3	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
update_pcouple_after_coordinates(_IO_FILE, long, PressureCouplingOptions const&, long, float, int const () [3], float const () [3], float, int, gmx::ArrayRef<unsigned short const>, float const () [3], float const () [3], float const () [3],...	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	NA	0.00	0.00	0.00	NA	3	4	4	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00	NA
__kmpc_global_thread_num	libiomp5.so	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	8	NA	NA	NA	0.01	NA	NA	NA	0.00
.plt.sec@start	libiomp5.so	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	8	NA	NA	NA	0.01	NA	NA	NA	0.00
atan2f	binary	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	9	NA	NA	NA	0.00	NA	NA	NA	0.00
gmx::PaddedVector<gmx::BasicVector<float>, gmx::Allocator<gmx::BasicVector<float>, gmx::HostAllocationPolicy> >::resizeWithPadding(long)	libgromacs_mpi.so.9.0.0	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00	NA	4	1	5	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00
vrescale_tcoupl(t_inputrec const, long, gmx_ekindata_t, float, gmx::ArrayRef<double>)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	6	2	1	1	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
MPIR_Bcast_intra_tree_generic	libmpi.so.12.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	4	2	2	2	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
__strcmp_evex	libc.so.6	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00	NA	3	7	1	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00
.omp_outlined.#0x5f8c30	libgromacs_mpi.so.9.0.0	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	11	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
sum_epot(gmx_grppairener_t const&, float*)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	NA	0.00	0.00	0.00	NA	6	2	2	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00	NA
OmptReturnAddressGuard::OmptReturnAddressGuard(int, void*)	libomp.so	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA	5	6	NA	NA	0.00	0.00	NA	NA	0.00	0.00	NA
mdoutf_get_tng_compressed_lambda_output_interval(gmx_mdoutf*)	libgromacs_mpi.so.9.0.0	0.00	NA	0.00	0.00	0.00	NA	0.00	0.00	2	NA	1	6	0.00	NA	0.00	0.00	0.00	NA	0.00	0.00
__strncpy_evex	libc.so.6	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	2	2	4	2	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
float gmx::NormalDistribution<float>::operator()<gmx::ThreeFry2x64<64u> >(gmx::ThreeFry2x64<64u>&, gmx::NormalDistribution<float>::param_type const&)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	NA	0.00	0.00	0.00	NA	5	1	4	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00	NA
init_forcerec(_IO_FILE, gmx::MDLogger const&, gmx::SimulationWorkload const&, t_forcerec, t_inputrec const&, gmx_mtop_t const&, t_commrec const, float () [3], char const, char const, gmx::ArrayRef<std::__cxx11::basic_string<char...	libgromacs_mpi.so.9.0.0	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00	NA	4	3	3	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00
do_nb_verlet(t_forcerec, interaction_const_t const, gmx_enerdata_t, gmx::StepWorkload const&, gmx::InteractionLocality, int, long, t_nrnb, gmx_wallcycle*) [clone .part.0]	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	9	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
gmx::Update::update_sd_second_half(t_inputrec const&, long, float, int, gmx::ArrayRef<ParticleType const>, gmx::ArrayRef<float const>, t_state, t_commrec const, t_nrnb, gmx_wallcycle, gmx::Constraints, bool, bool)	libgromacs_mpi.so.9.0.0	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00	NA	1	7	2	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00
gmx::Update::deform() const	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	5	1	2	1	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
calc_vcm_grp(t_mdatoms const&, gmx::ArrayRef<gmx::BasicVector<float> const>, gmx::ArrayRef<gmx::BasicVector<float> const>, t_vcm*) [clone .extracted]	libgromacs_mpi.so.9.0.0	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	8	NA	NA	NA	0.00	NA	NA	NA	0.00
___kmp_allocate	libiomp5.so	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	8	NA	NA	NA	0.00	NA	NA	NA	0.00
scalable_aligned_malloc	libiomp5.so	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	8	NA	NA	NA	0.00	NA	NA	NA	0.00
.omp_outlined.#0xace4c0	libgromacs_mpi.so.9.0.0	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	10	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
__kmp_api_omp_get_thread_num	libomp.so	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA	3	7	NA	NA	0.00	0.00	NA	NA	0.00	0.00	NA
___kmp_free	libomp.so	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA	3	7	NA	NA	0.00	0.00	NA	NA	0.00	0.00	NA
postProcessForceWithShiftForces(t_nrnb, gmx_wallcycle, float const () [3], gmx::ArrayRef<gmx::BasicVector<float> const>, gmx::ForceOutputs, float () [3], t_mdatoms const&, t_forcerec const&, gmx::VirtualSitesHandler, gmx::StepWork...	libgromacs_mpi.so.9.0.0	NA	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA	1	7	NA	NA	0.00	0.00	NA	NA	0.00	0.00
.omp_outlined.#0xb47030	libgromacs_mpi.so.9.0.0	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	10	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
__GI___libc_read	libc.so.6	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	3	1	3	1	0.00	0.00	0.02	0.00	0.00	0.00	0.00	0.00
gmx::Update::xp()	libgromacs_mpi.so.9.0.0	0.00	0.00	NA	0.00	0.00	0.00	NA	0.00	3	1	NA	4	0.00	0.00	NA	0.00	0.00	0.00	NA	0.00
Nbnxm::Grid::setDimensions(int, int, gmx::BasicVector<float>, gmx::BasicVector<float>, float*, float, bool, gmx::PinningPolicy)	libgromacs_mpi.so.9.0.0	0.00	0.00	NA	0.00	0.00	0.00	NA	0.00	1	2	NA	5	0.00	0.00	NA	0.00	0.00	0.00	NA	0.00
@plt_start@	libmpi.so.12.0.0	0.00	0.00	NA	0.00	0.00	0.00	NA	0.00	4	1	NA	3	0.00	0.00	NA	0.00	0.00	0.00	NA	0.00
ForeignLambdaTerms::zeroAllTerms()	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	8	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
reset_dvdl_enerdata(gmx_enerdata_t*)	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	8	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
make_dp_periodic(float*)	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	7	NA	NA	NA	0.01	NA	NA	NA	0.00	NA	NA	NA
gmx::Update::Impl::update_coords(t_inputrec const&, long, int, bool, gmx::ArrayRef<ParticleType const>, gmx::ArrayRef<float const>, gmx::ArrayRef<gmx::BasicVector<float> const>, t_state*, gmx::ArrayRefWithPadding<gmx::BasicVe...	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	8	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
MPIC_Recv	libmpi.so.12.0.0	0.00	NA	0.00	0.00	0.00	NA	0.00	0.00	2	NA	2	4	0.00	NA	0.00	0.00	0.00	NA	0.00	0.00
get_pme_ener_vir_q(pme_solve_work_t, int, PmeOutput)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	1	1	2	4	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
gmx_reverse_top_t::hasPositionRestraints() const	libgromacs_mpi.so.9.0.0	0.00	NA	0.00	0.00	0.00	NA	0.00	0.00	1	NA	3	4	0.00	NA	0.00	0.00	0.00	NA	0.00	0.00
MPID_Progress_end	libmpi.so.12.0.0	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00	NA	3	1	4	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00
impi_shm_heap_is_valid_pointer	libmpi.so.12.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	3	2	1	2	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
vrescale_resamplekin(float, float, float, float, long, long)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	4	1	2	1	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
gmx::SettleData::setConstraints(InteractionList const&, int, gmx::ArrayRef<float const>, gmx::ArrayRef<float const>)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	2	2	2	2	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
void doStopComMotionLinear<3>(t_mdatoms const&, gmx::ArrayRef<gmx::BasicVector<float> >, t_vcm const&)	libgromacs_mpi.so.9.0.0	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	7	NA	NA	NA	0.00	NA	NA	NA	0.00
__libm_logf_l9	binary	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	6	NA	NA	NA	0.02	NA	NA	NA	0.00
__strlen_evex	libc.so.6	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	3	2	1	1	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
dd_numHomeAtoms(gmx_domdec_t const&)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	3	2	2	1	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
gmx::ThreadedForceBuffer<float [4]>::setupReduction()	libgromacs_mpi.so.9.0.0	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00	NA	2	2	3	NA	0.00	0.02	0.00	NA	0.00	0.00	0.00
std::vector<float, gmx::DefaultInitializationAllocator<float, std::allocator<float> > >::_M_default_append(unsigned long)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	NA	0.00	0.00	0.00	NA	2	4	2	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00	NA
int& std::vector<int, std::allocator<int> >::emplace_back<int>(int&&) [clone .isra.0]	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	6	NA	NA	NA	0.02	NA	NA	NA	0.00	NA	NA	NA
t_state::changeNumAtoms(int)	libgromacs_mpi.so.9.0.0	0.00	NA	0.00	0.00	0.00	NA	0.00	0.00	4	NA	1	2	0.00	NA	0.00	0.00	0.00	NA	0.00	0.00
gmx::Update::Impl::update_sd_second_half(t_inputrec const&, long, float, int, gmx::ArrayRef<ParticleType const>, gmx::ArrayRef<float const>, t_state, t_commrec const, t_nrnb, gmx_wallcycle, gmx::Constraints, bool, bool)	libgromacs_mpi.so.9.0.0	0.00	NA	0.00	0.00	0.00	NA	0.00	0.00	4	NA	1	2	0.00	NA	0.00	0.00	0.00	NA	0.00	0.00
pressureError(gmx::ArrayRef<VerletbufAtomtype const>, gmx_ffparams_t const&, t_inputrec const&, float, std::pair<pot_derivatives_t, pot_derivatives_t> const&, bool, int, float, VerletbufListSetup const&, int, float)	libgromacs_mpi.so.9.0.0	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00	NA	2	5	1	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00
accumulatePotentialEnergies(gmx_enerdata_t, gmx::ArrayRef<float const>, t_lambda const)	libgromacs_mpi.so.9.0.0	0.00	0.00	NA	0.00	0.00	0.00	NA	0.00	2	2	NA	3	0.00	0.00	NA	0.00	0.00	0.00	NA	0.00
DispersionCorrection::TopologyParams::TopologyParams(gmx_mtop_t const&, t_inputrec const&, bool, int, gmx::ArrayRef<float const>)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	2	1	1	3	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
extract_binr(t_bin*, int, gmx::ArrayRef<float>)	libgromacs_mpi.so.9.0.0	0.00	NA	0.00	0.00	0.00	NA	0.00	0.00	5	NA	1	1	0.00	NA	0.00	0.00	0.00	NA	0.00	0.00
__kmpc_master	libomp.so	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA	6	2	NA	NA	0.00	0.00	NA	NA	0.00	0.00	NA
nonbonded_verlet_t::putAtomsOnGrid(float const () [3], int, float const, float const, gmx::UpdateGroupsCog const, gmx::Range<int>, float, gmx::ArrayRef<long const>, gmx::ArrayRef<gmx::BasicVector<float> const>, int, int const*)	libgromacs_mpi.so.9.0.0	0.00	0.00	NA	0.00	0.00	0.00	NA	0.00	4	2	NA	1	0.00	0.00	NA	0.00	0.00	0.00	NA	0.00
__GI_____strtoul_l_internal	libc.so.6	0.00	0.00	NA	0.00	0.00	0.00	NA	0.00	2	3	NA	2	0.00	0.00	NA	0.00	0.00	0.00	NA	0.00
inputrecDeform(t_inputrec const*)	libgromacs_mpi.so.9.0.0	0.00	0.00	NA	NA	0.00	0.00	NA	NA	5	2	NA	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA
_IO_file_xsputn	libc.so.6	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	1	1	1	1	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
__memcmp_evex_movbe	libc.so.6	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	1	2	2	2	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
hack_digit	libc.so.6	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	1	1	1	1	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
dd_make_local_top(gmx_domdec_t const&, gmx_domdec_zones_t const&, int, float () [3], float, int const, t_forcerec, gmx::ArrayRef<gmx::BasicVector<float> const>, gmx_mtop_t const&, gmx::ArrayRef<long const>, gmx_localtop_...	libgromacs_mpi.so.9.0.0	0.00	0.00	NA	0.00	0.00	0.00	NA	0.00	1	5	NA	1	0.00	0.00	NA	0.00	0.00	0.00	NA	0.00
mkl_dft_def_ownscDftFwd_PrimeFact_32fc@plt	libmkl_def.so.2	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	1	3	2	1	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
__mpn_mul_1	libc.so.6	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00	NA	1	1	1	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00
mdoutf_get_tng_compressed_box_output_interval(gmx_mdoutf*)	libgromacs_mpi.so.9.0.0	0.00	NA	NA	0.00	0.00	NA	NA	0.00	4	NA	NA	2	0.00	NA	NA	0.00	0.00	NA	NA	0.00
mkl_dft_def_ownscDftInv_PrimeFact_32fc@plt	libmkl_def.so.2	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00	NA	3	3	1	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00
std::vector<int, gmx::DefaultInitializationAllocator<int, std::allocator<int> > >::_M_default_append(unsigned long)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	NA	0.00	0.00	0.00	NA	1	2	4	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00	NA
mdoutf_get_tng_lambda_output_interval(gmx_mdoutf*)	libgromacs_mpi.so.9.0.0	0.00	0.00	NA	0.00	0.00	0.00	NA	0.00	3	1	NA	2	0.00	0.00	NA	0.00	0.00	0.00	NA	0.00
gomp_init_task	libgomp.so.1.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	6	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
pme_dd_sendrecv(PmeAtomComm, bool, int, void, int, void*, int) [clone .constprop.0]	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	6	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
gmx::Constraints::Impl::apply(bool, bool, long, int, float, gmx::ArrayRefWithPadding<gmx::BasicVector<float> >, gmx::ArrayRefWithPadding<gmx::BasicVector<float> >, gmx::ArrayRef<gmx::BasicVector<float> >, float const (*)...	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	6	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
.omp_outlined.#0xb45160	libgromacs_mpi.so.9.0.0	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	6	NA	NA	NA	0.01	NA	NA	NA	0.00	NA	NA
calc_pres(PbcType, int, float const () [3], float const () [3], float const () [3], float () [3])	libgromacs_mpi.so.9.0.0	NA	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA	2	4	NA	NA	0.00	0.00	NA	NA	0.00	0.00
__strchrnul_evex	libc.so.6	0.00	0.00	NA	0.00	0.00	0.00	NA	0.00	1	1	NA	1	0.00	0.00	NA	0.00	0.00	0.00	NA	0.00
.plt.sec@start	libstdc++.so.6.0.29	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA	2	5	NA	NA	0.00	0.00	NA	NA	0.00	0.00	NA
gmx::LocalAtomSetManager::setIndicesInDomainDecomposition(gmx_ga2la_t const&)	libgromacs_mpi.so.9.0.0	0.00	0.00	NA	0.00	0.00	0.00	NA	0.00	2	2	NA	2	0.00	0.00	NA	0.00	0.00	0.00	NA	0.00
MPIDI_POSIX_coll_select	libmpi.so.12.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	2	1	1	2	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
gmx::ObservablesReducer::markAsReadyToReduce()	libgromacs_mpi.so.9.0.0	NA	0.00	NA	0.00	NA	0.00	NA	0.00	NA	3	NA	3	NA	0.00	NA	0.00	NA	0.00	NA	0.00
do_ilists(gmx::ISerializer, std::array<InteractionList, 94ul>, int)	libgromacs_mpi.so.9.0.0	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00	NA	2	1	3	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00
ForeignLambdaTerms::finalizePotentialContributions(gmx::EnumerationArray<FreeEnergyPerturbationCouplingType, double, (FreeEnergyPerturbationCouplingType)7> const&, gmx::ArrayRef<float const>, t_lambda const&)	libgromacs_mpi.so.9.0.0	0.00	0.00	NA	0.00	0.00	0.00	NA	0.00	1	3	NA	2	0.00	0.00	NA	0.00	0.00	0.00	NA	0.00
sysmalloc	libc.so.6	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	1	2	1	2	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
__memchr_evex	libc.so.6	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	2	2	1	1	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
MPIR_SUM_check_dtype	libmpi.so.12.0.0	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00	NA	3	1	2	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00
update_pcouple_before_coordinates(gmx::MDLogger const&, long, PressureCouplingOptions const&, float const () [3], float, t_state, gmx::MultiDimArray<std::array<float, 9ul>, gmx::extents<3l, 3l>, gmx::layout_right>*, gmx::MultiDi...	libgromacs_mpi.so.9.0.0	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00	NA	2	2	2	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00
gmx_mtop_particletype_count(gmx_mtop_t const&)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	NA	0.00	0.00	0.00	NA	2	2	2	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00	NA
__kmp_pop_current_task_from_thread	libiomp5.so	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	5	NA	NA	NA	0.00	NA	NA	NA	0.00
std::vector<gmx::BasicVector<float>, gmx::Allocator<gmx::BasicVector<float>, gmx::HostAllocationPolicy> >::resize(unsigned long)	libgromacs_mpi.so.9.0.0	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	5	NA	NA	NA	0.00	NA	NA	NA	0.00
gmx_pme_do(gmx_pme_t*, gmx::ArrayRef<gmx::BasicVector<float> const>, gmx::ArrayRef<gmx::BasicVector<float> >, gmx::ArrayRef<float const>, gmx::ArrayRef<float const>, gmx::ArrayRef<float const>, gmx::ArrayRef<flo...	libgromacs_mpi.so.9.0.0	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	4	NA	NA	NA	0.02	NA	NA	NA	0.00
__kmpc_end_masked	libiomp5.so	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	5	NA	NA	NA	0.00	NA	NA	NA	0.00
setup_bonded_threading(bonded_threading_t*, int, bool, InteractionDefinitions const&)	libgromacs_mpi.so.9.0.0	NA	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA	5	1	NA	NA	0.00	0.00	NA	NA	0.00	0.00
MPIDIU_create_buf_pool	libmpi.so.12.0.0	0.00	0.00	NA	0.00	0.00	0.00	NA	0.00	1	1	NA	3	0.00	0.00	NA	0.00	0.00	0.00	NA	0.00
ewald_charge_correction(t_commrec const, float, float, gmx::ArrayRef<double const>, float, float const () [3], float, float () [3])	libgromacs_mpi.so.9.0.0	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA	3	3	NA	NA	0.00	0.00	NA	NA	0.00	0.00	NA
std::_Function_handler<gmx::StopSignal (), gmx::StopHandlerBuilder::getStopHandlerMD(gmx::compat::not_null<gmx::SimulationSignal>, bool, bool, int, bool, int, float, bool, _IO_FILE, long const&, bool const&, gmx_walltime_accounting*)::$_...	libgromacs_mpi.so.9.0.0	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA	3	3	NA	NA	0.00	0.00	NA	NA	0.00	0.00	NA
amd_cos_zn4	libalm.so	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	6	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
_mid_memalign.constprop.0	libc.so.6	0.00	NA	NA	NA	0.00	NA	NA	NA	5	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
gmx::Constraints::apply(bool, bool, long, int, float, gmx::ArrayRefWithPadding<gmx::BasicVector<float> >, gmx::ArrayRefWithPadding<gmx::BasicVector<float> >, gmx::ArrayRef<gmx::BasicVector<float> >, float const (*) [3], ...	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	5	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
float gmx::GammaDistribution<float>::operator()<gmx::ThreeFry2x64<64u> >(gmx::ThreeFry2x64<64u>&, gmx::GammaDistribution<float>::param_type const&) [clone .isra.0]	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	5	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
ListedForces::haveCpuBondeds() const	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	5	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
gomp_init_work_share	libgomp.so.1.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	5	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
inflate_table	libmpi.so.12.0.0	0.00	NA	0.00	0.00	0.00	NA	0.00	0.00	3	NA	1	1	0.00	NA	0.00	0.00	0.00	NA	0.00	0.00
void ddSendrecv<int>(gmx_domdec_t const*, int, int, gmx::ArrayRef<int>, gmx::ArrayRef<int>)	libgromacs_mpi.so.9.0.0	0.00	0.00	NA	NA	0.00	0.00	NA	NA	4	1	NA	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA
_IO_fgets	libc.so.6	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	1	1	1	2	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
NPT_energy(PressureCouplingOptions const&, TemperatureCoupling, gmx::ArrayRef<float const>, gmx_ekindata_t const&, bool, t_state const, t_extmass const)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	2	1	1	1	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
Nbnxm::GridSet::putOnGrid(float const () [3], int, float const, float const, gmx::UpdateGroupsCog const, gmx::Range<int>, float, gmx::ArrayRef<long const>, gmx::ArrayRef<gmx::BasicVector<float> const>, int, int const*, nbnxn_ato...	libgromacs_mpi.so.9.0.0	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00	NA	1	2	2	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00
std::vector<Nbnxm::BoundingBox1D, std::allocator<Nbnxm::BoundingBox1D> >::_M_default_append(unsigned long)	libgromacs_mpi.so.9.0.0	0.00	0.00	NA	NA	0.00	0.00	NA	NA	1	4	NA	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA
__I_MPI___intel_sse2_strlen	libmpifort.so.12.0.0	0.00	0.00	0.00	NA	0.00	0.00	0.00	NA	1	3	1	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00	NA
set_pbc_dd(t_pbc, PbcType, int const, bool, float const (*) [3])	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	NA	0.00	0.00	0.00	NA	1	2	1	NA	0.00	0.02	0.00	NA	0.00	0.00	0.00	NA
___kmp_free	libiomp5.so	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	4	NA	NA	NA	0.00	NA	NA	NA	0.00
__kmpc_masked	libiomp5.so	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	4	NA	NA	NA	0.00	NA	NA	NA	0.00
.omp_outlined..51	libgromacs_mpi.so.9.0.0	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA	3	2	NA	NA	0.00	0.00	NA	NA	0.00	0.00	NA
.plt.sec@start	libstdc++.so.6.0.32	0.00	NA	NA	0.00	0.00	NA	NA	0.00	1	NA	NA	3	0.00	NA	NA	0.00	0.00	NA	NA	0.00
operator new(unsigned long)	libstdc++.so.6.0.29	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA	2	3	NA	NA	0.00	0.00	NA	NA	0.00	0.00	NA
std::vector<gmx::BasicVector<float>, gmx::Allocator<gmx::BasicVector<float>, gmx::HostAllocationPolicy> >::reserve(unsigned long)	libgromacs_mpi.so.9.0.0	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA	2	3	NA	NA	0.00	0.00	NA	NA	0.00	0.00	NA
acosf	libalm.so	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	5	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
__rawmemchr_evex	libc.so.6	0.00	NA	NA	0.00	0.00	NA	NA	0.00	2	NA	NA	2	0.00	NA	NA	0.00	0.00	NA	NA	0.00
InteractionDefinitions::clear()	libgromacs_mpi.so.9.0.0	NA	0.00	NA	0.00	NA	0.00	NA	0.00	NA	1	NA	3	NA	0.00	NA	0.00	NA	0.00	NA	0.00
operator new(unsigned long)	libstdc++.so.6.0.32	0.00	NA	NA	0.00	0.00	NA	NA	0.00	3	NA	NA	1	0.00	NA	NA	0.00	0.00	NA	NA	0.00
MPI_Gather	libmpi.so.12.0.0	NA	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA	1	3	NA	NA	0.00	0.00	NA	NA	0.00	0.00
MPIDI_coll_get_next_container	libmpi.so.12.0.0	0.00	0.00	NA	0.00	0.00	0.00	NA	0.00	1	1	NA	2	0.00	0.00	NA	0.00	0.00	0.00	NA	0.00
__GI___libc_memalign	libc.so.6	0.00	NA	NA	NA	0.00	NA	NA	NA	4	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
gmx_pme_send_coeffs_coords(t_forcerec, t_commrec const, unsigned int, gmx::ArrayRef<float const>, gmx::ArrayRef<float const>, gmx::ArrayRef<float const>, gmx::ArrayRef<float const>, gmx::ArrayRef<float const>, gmx::ArrayRef&...	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	4	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
gomp_aligned_alloc	libgomp.so.1.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	4	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
gmx::SimulationSignaller::finalizeSignals()	libgromacs_mpi.so.9.0.0	0.00	0.00	NA	0.00	0.00	0.00	NA	0.00	2	1	NA	1	0.00	0.00	NA	0.00	0.00	0.00	NA	0.00
inputrecNvtTrotter(t_inputrec const*)	libgromacs_mpi.so.9.0.0	0.00	0.00	NA	0.00	0.00	0.00	NA	0.00	2	1	NA	1	0.00	0.00	NA	0.00	0.00	0.00	NA	0.00
numPbcDimensions(PbcType)	libgromacs_mpi.so.9.0.0	0.00	0.00	NA	0.00	0.00	0.00	NA	0.00	2	1	NA	1	0.00	0.00	NA	0.00	0.00	0.00	NA	0.00
MPIC_Send	libmpi.so.12.0.0	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00	NA	1	1	2	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00
gmx_sumd(unsigned long, double, t_commrec const)	libgromacs_mpi.so.9.0.0	0.00	NA	0.00	NA	0.00	NA	0.00	NA	3	NA	1	NA	0.00	NA	0.00	NA	0.00	NA	0.00	NA
reduce_energies_over_lists(nbnxn_atomdata_t const, int, float, float*)	libgromacs_mpi.so.9.0.0	NA	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA	2	2	NA	NA	0.00	0.00	NA	NA	0.00	0.00
gmx::ThreadForceBuffer<float [4]>::resizeBufferAndClearMask(int)	libgromacs_mpi.so.9.0.0	0.00	0.00	NA	0.00	0.00	0.00	NA	0.00	1	2	NA	1	0.00	0.00	NA	0.00	0.00	0.00	NA	0.00
make_tric_corr_matrix(int, float const () [3], float () [3])	libgromacs_mpi.so.9.0.0	0.00	0.00	NA	0.00	0.00	0.00	NA	0.00	1	2	NA	1	0.00	0.00	NA	0.00	0.00	0.00	NA	0.00
gmx::ObservablesReducer::reductionComplete(long)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00	1	1	1	1	0.00	0.00	0.00	0.00	0.00	0.00	0.00	0.00
dd_check_ftype(int, ReverseTopOptions const&)	libgromacs_mpi.so.9.0.0	0.00	0.00	NA	NA	0.00	0.00	NA	NA	1	1	NA	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA
make_tables(_IO_FILE, interaction_const_t const, char const*, float, int)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	NA	0.00	0.00	0.00	NA	2	1	1	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00	NA
atoms2md(gmx_mtop_t const&, t_inputrec const&, int, gmx::ArrayRef<int>, int, gmx::MDAtoms*)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	NA	0.00	0.00	0.00	NA	2	1	1	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00	NA
gmx::init_lincs(_IO_FILE, gmx_mtop_t const&, int, gmx::ArrayRef<gmx::ListOfLists<int> const>, bool, int, int, gmx::ObservablesReducerBuilder)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	NA	0.00	0.00	0.00	NA	2	1	1	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00	NA
MPIDI_SHMGR_Release_bcast	libmpi.so.12.0.0	0.00	NA	0.00	NA	0.00	NA	0.00	NA	2	NA	2	NA	0.00	NA	0.00	NA	0.00	NA	0.00	NA
computeAtomGroupDomainIndex(gmx_domdec_t const&, gmx_ddbox_t const&, float const (&) [3][3], gmx::ArrayRef<std::vector<float, std::allocator<float> > const>, int, int, float const () [3], float () [3], float (*) [3])	libgromacs_mpi.so.9.0.0	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00	NA	1	1	1	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00
_GLOBAL__sub_I_tabulatednormaldistribution.cpp	libgromacs_mpi.so.9.0.0	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00	NA	1	2	1	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00
add_binr(t_bin*, gmx::ArrayRef<float const>)	libgromacs_mpi.so.9.0.0	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00	NA	1	2	1	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00
MPI_Allreduce	libmpi.so.12.0.0	0.00	0.00	0.00	NA	0.00	0.00	0.00	NA	1	2	1	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00	NA
std::vector<float, gmx::Allocator<float, gmx::HostAllocationPolicy> >::_M_default_append(unsigned long)	libgromacs_mpi.so.9.0.0	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA	3	1	NA	NA	0.00	0.00	NA	NA	0.00	0.00	NA
std::vector<nbnxn_cj_t, gmx::DefaultInitializationAllocator<nbnxn_cj_t, std::allocator<nbnxn_cj_t> > >::_M_default_append(unsigned long)	libgromacs_mpi.so.9.0.0	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA	3	1	NA	NA	0.00	0.00	NA	NA	0.00	0.00	NA
__GI_____strtol_l_internal	libc.so.6	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA	3	1	NA	NA	0.00	0.00	NA	NA	0.00	0.00	NA
.omp_outlined..22	libgromacs_mpi.so.9.0.0	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA	2	2	NA	NA	0.00	0.00	NA	NA	0.00	0.00	NA
gmx::constr_r_max(gmx::MDLogger const&, gmx_mtop_t const, t_inputrec const)	libgromacs_mpi.so.9.0.0	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA	2	2	NA	NA	0.00	0.00	NA	NA	0.00	0.00	NA
dd_bonded_cg_distance(gmx::MDLogger const&, gmx_mtop_t const&, t_inputrec const&, gmx::ArrayRef<gmx::BasicVector<float> const>, float const () [3], gmx::DDBondedChecking, float, float*)	libgromacs_mpi.so.9.0.0	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA	1	1	NA	NA	0.00	0.00	NA	NA	0.00	0.00	NA
___kmp_allocate	libomp.so	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA	1	3	NA	NA	0.00	0.00	NA	NA	0.00	0.00	NA
gmx::Constraints::Impl::apply(bool, bool, long, int, float, gmx::ArrayRefWithPadding<gmx::BasicVector<float> >, gmx::ArrayRefWithPadding<gmx::BasicVector<float> >, gmx::ArrayRef<gmx::BasicVector<float> >, float const (*)...	libgromacs_mpi.so.9.0.0	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	3	NA	NA	NA	0.00	NA	NA	NA	0.00
std::vector<nbnxn_cj_t, gmx::DefaultInitializationAllocator<nbnxn_cj_t, std::allocator<nbnxn_cj_t> > >::resize(unsigned long)	libgromacs_mpi.so.9.0.0	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	3	NA	NA	NA	0.00	NA	NA	NA	0.00
sincosf	binary	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	3	NA	NA	NA	0.00	NA	NA	NA	0.00
__libm_log_z0	binary	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	3	NA	NA	NA	0.00	NA	NA	NA	0.00
__kmpc_push_num_threads	libiomp5.so	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	3	NA	NA	NA	0.00	NA	NA	NA	0.00
__kmpc_serialized_parallel	libiomp5.so	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	3	NA	NA	NA	0.00	NA	NA	NA	0.00
gmx::SimulationSignaller::getCommunicationBuffer()	libgromacs_mpi.so.9.0.0	0.00	NA	NA	0.00	0.00	NA	NA	0.00	2	NA	NA	1	0.00	NA	NA	0.00	0.00	NA	NA	0.00
gmx::SimulationSignaller::signalInterSim()	libgromacs_mpi.so.9.0.0	0.00	NA	NA	0.00	0.00	NA	NA	0.00	2	NA	NA	1	0.00	NA	NA	0.00	0.00	NA	NA	0.00
calcVerletBufferSize(gmx_mtop_t const&, float, t_inputrec const&, float, int, int, float, VerletbufListSetup const&)	libgromacs_mpi.so.9.0.0	0.00	NA	NA	0.00	0.00	NA	NA	0.00	2	NA	NA	1	0.00	NA	NA	0.00	0.00	NA	NA	0.00
gmx::ThreadForceBuffer<float [4]>::processMask()	libgromacs_mpi.so.9.0.0	0.00	NA	NA	0.00	0.00	NA	NA	0.00	2	NA	NA	1	0.00	NA	NA	0.00	0.00	NA	NA	0.00
gmx::PaddedVector<gmx::BasicVector<float>, gmx::Allocator<gmx::BasicVector<float>, gmx::AlignedAllocationPolicy> >::resizeWithPadding(long)	libgromacs_mpi.so.9.0.0	NA	0.00	NA	0.00	NA	0.00	NA	0.00	NA	1	NA	2	NA	0.00	NA	0.00	NA	0.00	NA	0.00
getThreadAtomRange(int, int, int, int, int)	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	3	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
gmx_pme_do(gmx_pme_t*, gmx::ArrayRef<gmx::BasicVector<float> const>, gmx::ArrayRef<gmx::BasicVector<float> >, gmx::ArrayRef<float const>, gmx::ArrayRef<float const>, gmx::ArrayRef<float const>, gmx::ArrayRef<flo...	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	3	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
.plt.sec@start	libgomp.so.1.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	3	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
PairlistSet::constructPairlists(gmx::InteractionLocality, Nbnxm::GridSet const&, gmx::ArrayRef<PairsearchWork>, nbnxn_atomdata_t, gmx::ListOfLists<int> const&, int, t_nrnb, SearchCycleCounting*) [clone ._omp_fn.0]	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	3	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
dd_move_cellx(gmx_domdec_t, gmx_ddbox_t const, float, float)	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	3	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
std::vector<Nbnxm::BoundingBox, gmx::Allocator<Nbnxm::BoundingBox, gmx::AlignedAllocationPolicy> >::_M_default_append(unsigned long)	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	3	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
nonbonded_verlet_t::constructPairlist(gmx::InteractionLocality, gmx::ListOfLists<int> const&, long, t_nrnb*) const	libgromacs_mpi.so.9.0.0	0.00	0.00	NA	0.00	0.00	0.00	NA	0.00	1	1	NA	1	0.00	0.00	NA	0.00	0.00	0.00	NA	0.00
msort_with_tmp.part.0	libc.so.6	0.00	0.00	NA	0.00	0.00	0.00	NA	0.00	1	1	NA	1	0.00	0.00	NA	0.00	0.00	0.00	NA	0.00
PairlistSets::construct(gmx::InteractionLocality, PairSearch, nbnxn_atomdata_t, gmx::ListOfLists<int> const&, long, t_nrnb*)	libgromacs_mpi.so.9.0.0	0.00	NA	0.00	0.00	0.00	NA	0.00	0.00	1	NA	1	1	0.00	NA	0.00	0.00	0.00	NA	0.00	0.00
mkl_serv_get_ncorespercpu	libmkl_sequential.so.2	0.00	NA	0.00	0.00	0.00	NA	0.00	0.00	1	NA	1	1	0.00	NA	0.00	0.00	0.00	NA	0.00	0.00
erf	libm.so.6	0.00	0.00	NA	NA	0.00	0.00	NA	NA	2	1	NA	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA
get_nsgrid_boundaries(int, float () [3], gmx_domdec_t, gmx_ddbox_t, gmx::BasicVector<float>, gmx::BasicVector<float>, int, float () [3], float, float)	libgromacs_mpi.so.9.0.0	0.00	0.00	NA	NA	0.00	0.00	NA	NA	2	1	NA	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA
unknown_function	[vdso]	0.00	0.00	NA	NA	0.00	0.00	NA	NA	2	1	NA	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA
gmx::Mdrunner::mdrunner()	libgromacs_mpi.so.9.0.0	0.00	0.00	NA	NA	0.00	0.00	NA	NA	2	1	NA	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA
ListedForces::setup(InteractionDefinitions const&, int, bool)	libgromacs_mpi.so.9.0.0	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00	NA	1	1	1	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00
mkl__blas_clean_jit_hashtable	libmkl_core.so.2	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00	NA	1	1	1	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00
_IO_getline_info	libc.so.6	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00	NA	1	1	1	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00
gmx::makeUpdateGroupingsPerMoleculeType[abi:cxx11](gmx_mtop_t const&)	libgromacs_mpi.so.9.0.0	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00	NA	1	1	1	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00
gmx::(anonymous namespace)::translateCpuInfoLogicalProcessorsToMachine(std::vector<gmx::CpuInfo::LogicalProcessor, std::allocator<gmx::CpuInfo::LogicalProcessor> > const&, gmx::HardwareTopology::Machine*)	libgromacs_mpi.so.9.0.0	NA	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA	2	1	NA	NA	0.00	0.00	NA	NA	0.00	0.00
mkl_dft_def_owns_cRealRecombine_32f@plt	libmkl_def.so.2	0.00	0.00	0.00	NA	0.00	0.00	0.00	NA	1	1	1	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00	NA
_IO_padn	libc.so.6	0.00	0.00	0.00	NA	0.00	0.00	0.00	NA	1	1	1	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00	NA
set_dd_cell_sizes(gmx_domdec_t, gmx_ddbox_t const, bool, bool, bool, long, gmx_wallcycle*)	libgromacs_mpi.so.9.0.0	0.00	0.00	0.00	NA	0.00	0.00	0.00	NA	1	1	1	NA	0.00	0.00	0.00	NA	0.00	0.00	0.00	NA
MPI_Bcast	libmpi.so.12.0.0	0.00	NA	0.00	NA	0.00	NA	0.00	NA	1	NA	2	NA	0.00	NA	0.00	NA	0.00	NA	0.00	NA
gmx::ObservablesReducer::communicationBuffer(bool)	libgromacs_mpi.so.9.0.0	0.00	NA	0.00	NA	0.00	NA	0.00	NA	1	NA	2	NA	0.00	NA	0.00	NA	0.00	NA	0.00	NA
.omp_outlined.#0x66eb40	libgromacs_mpi.so.9.0.0	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	3	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
MPIR_Datatype_init_predefined	libmpi.so.12.0.0	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	3	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
I_MPI_memcpy_function_setup	libmpi.so.12.0.0	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA	2	1	NA	NA	0.00	0.00	NA	NA	0.00	0.00	NA
void gmx::internal::highBitCounter::increment<unsigned long, 2ul, 7u>(std::array<unsigned long, 2ul>*, unsigned long)	libgromacs_mpi.so.9.0.0	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA	2	1	NA	NA	0.00	0.00	NA	NA	0.00	0.00	NA
std::vector<gmx::BasicVector<float>, gmx::Allocator<gmx::BasicVector<float>, gmx::AlignedAllocationPolicy> >::reserve(unsigned long)	libgromacs_mpi.so.9.0.0	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA	2	1	NA	NA	0.00	0.00	NA	NA	0.00	0.00	NA
gmx::lincs_rmsd(gmx::Lincs const*)	libgromacs_mpi.so.9.0.0	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA	1	1	NA	NA	0.00	0.00	NA	NA	0.00	0.00	NA
std::_Rb_tree_insert_and_rebalance(bool, std::_Rb_tree_node_base, std::_Rb_tree_node_base, std::_Rb_tree_node_base&)	libstdc++.so.6.0.29	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA	1	2	NA	NA	0.00	0.00	NA	NA	0.00	0.00	NA
std::vector<gmx::BasicVector<int>, gmx::DefaultInitializationAllocator<gmx::BasicVector<int>, std::allocator<gmx::BasicVector<int> > > >::_M_default_append(unsigned long)	libgromacs_mpi.so.9.0.0	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA	1	2	NA	NA	0.00	0.00	NA	NA	0.00	0.00	NA
MPIDI_SHMGR_build_comm_map	libmpi.so.12.0.0	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA	1	2	NA	NA	0.00	0.00	NA	NA	0.00	0.00	NA
.omp_outlined.#0xacfa20	libgromacs_mpi.so.9.0.0	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	3	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
amd_expf	libalm.so	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	3	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
alci::Cpu::Cpu(unsigned int)	libalm.so	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	3	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
amd_atan2f	libalm.so	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	3	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
amd_cos	libalm.so	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	3	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
.omp_outlined.#0x6ad7e0	libgromacs_mpi.so.9.0.0	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	3	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
std::vector<gmx::BasicVector<float>, gmx::Allocator<gmx::BasicVector<float>, gmx::HostAllocationPolicy> >::_M_default_append(unsigned long)	libgromacs_mpi.so.9.0.0	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	3	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
inflate	libmpi.so.12.0.0	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	3	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
operator delete(void*)	libstdc++.so.6.0.32	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	2	NA	NA	NA	0.00	NA	NA	NA	0.00
__GI___clock_gettime	libc.so.6	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	2	NA	NA	NA	0.00	NA	NA	NA	0.00
Nbnxm::generateAndFill2DGrid(Nbnxm::Grid, gmx::ArrayRef<Nbnxm::GridWork>, std::vector<int, gmx::Allocator<int, gmx::HostAllocationPolicy> >, float const, float const, gmx::UpdateGroupsCog const, gmx::Range<int>, float, float, ...	libgromacs_mpi.so.9.0.0	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	2	NA	NA	NA	0.00	NA	NA	NA	0.00
gmx::ThreeFry2x64General<20u, 64u>::operator()()	libgromacs_mpi.so.9.0.0	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	2	NA	NA	NA	0.00	NA	NA	NA	0.00
Nbnxm::Grid::setCellIndices(int, int, Nbnxm::GridSetData, gmx::ArrayRef<Nbnxm::GridWork>, gmx::Range<int>, gmx::ArrayRef<long const>, gmx::ArrayRef<gmx::BasicVector<float> const>, int, nbnxn_atomdata_t) [clone .extracted]	libgromacs_mpi.so.9.0.0	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	2	NA	NA	NA	0.00	NA	NA	NA	0.00
reset_bin(t_bin*)	libgromacs_mpi.so.9.0.0	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	2	NA	NA	NA	0.00	NA	NA	NA	0.00
MPIR_Comm_create_subcomms	libmpi.so.12.0.0	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	2	NA	NA	NA	0.00	NA	NA	NA	0.00
gmx_mtop_ftype_count(gmx_mtop_t const&, int)	libgromacs_mpi.so.9.0.0	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	2	NA	NA	NA	0.00	NA	NA	NA	0.00
gmx::ISerializer::doUCharArray(unsigned char*, int)	libgromacs_mpi.so.9.0.0	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	2	NA	NA	NA	0.00	NA	NA	NA	0.00
gmx_reverse_top_t::options() const	libgromacs_mpi.so.9.0.0	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	2	NA	NA	NA	0.00	NA	NA	NA	0.00
gmx::Constraints::atom2settle_moltype() const	libgromacs_mpi.so.9.0.0	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	2	NA	NA	NA	0.00	NA	NA	NA	0.00
gmx_reverse_top_t::threadWorkObjects() const	libgromacs_mpi.so.9.0.0	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	2	NA	NA	NA	0.00	NA	NA	NA	0.00
__GI___open64_nocancel	ld-linux-x86-64.so.2	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	2	NA	NA	NA	0.00	NA	NA	NA	0.00
std::vector<float, gmx::Allocator<float, gmx::AlignedAllocationPolicy> >::resize(unsigned long)	libgromacs_mpi.so.9.0.0	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	2	NA	NA	NA	0.00	NA	NA	NA	0.00
_IO_file_underflow	libc.so.6	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	2	NA	NA	NA	0.00	NA	NA	NA	0.00
PairlistSet::dispatchPruneKernel(nbnxn_atomdata_t const*, gmx::ArrayRef<gmx::BasicVector<float> const>) [clone .extracted]	libgromacs_mpi.so.9.0.0	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	2	NA	NA	NA	0.00	NA	NA	NA	0.00
cos	binary	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	2	NA	NA	NA	0.00	NA	NA	NA	0.00
read_int	libc.so.6	0.00	NA	NA	0.00	0.00	NA	NA	0.00	1	NA	NA	1	0.00	NA	NA	0.00	0.00	NA	NA	0.00
calc_vcm_grp(t_mdatoms const&, gmx::ArrayRef<gmx::BasicVector<float> const>, gmx::ArrayRef<gmx::BasicVector<float> const>, t_vcm*)	libgromacs_mpi.so.9.0.0	0.00	NA	NA	0.00	0.00	NA	NA	0.00	1	NA	NA	1	0.00	NA	NA	0.00	0.00	NA	NA	0.00
_dl_check_map_versions	ld-linux-x86-64.so.2	0.00	NA	NA	0.00	0.00	NA	NA	0.00	1	NA	NA	1	0.00	NA	NA	0.00	0.00	NA	NA	0.00
__GI___libc_open	libc.so.6	0.00	NA	NA	0.00	0.00	NA	NA	0.00	1	NA	NA	1	0.00	NA	NA	0.00	0.00	NA	NA	0.00
gmx::log2I(int)	libgromacs_mpi.so.9.0.0	0.00	NA	NA	0.00	0.00	NA	NA	0.00	1	NA	NA	1	0.00	NA	NA	0.00	0.00	NA	NA	0.00
MPIR_Bcast	libmpi.so.12.0.0	0.00	NA	NA	0.00	0.00	NA	NA	0.00	1	NA	NA	1	0.00	NA	NA	0.00	0.00	NA	NA	0.00
getCoulombKernelType(Nbnxm::EwaldExclusionType, CoulombInteractionType, bool)	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	2	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
calc_vcm_grp(t_mdatoms const&, gmx::ArrayRef<gmx::BasicVector<float> const>, gmx::ArrayRef<gmx::BasicVector<float> const>, t_vcm*) [clone ._omp_fn.0]	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	2	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
MPIR_Gather_intra_binomial	libmpi.so.12.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	2	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
PairlistSet::dispatchPruneKernel(nbnxn_atomdata_t const*, gmx::ArrayRef<gmx::BasicVector<float> const>) [clone ._omp_fn.0]	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	2	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
PairlistSet::dispatchPruneKernel(nbnxn_atomdata_t const*, gmx::ArrayRef<gmx::BasicVector<float> const>)	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	2	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
energyDriftAtomPair(bool, bool, float, float, float, float, pot_derivatives_t const*) [clone .constprop.0] [clone .isra.0]	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	2	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
do_stopcm_grp(t_mdatoms const&, gmx::ArrayRef<gmx::BasicVector<float> >, gmx::ArrayRef<gmx::BasicVector<float> >, t_vcm const&) [clone ._omp_fn.0]	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	2	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
gmx::make_at2con(int, gmx::ArrayRef<InteractionList const>, gmx::ArrayRef<t_iparams const>, gmx::FlexibleConstraintTreatment)	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	2	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
gmx::formatStringV[abi:cxx11](char const, __va_list_tag)	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	2	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
cbrtf	libm.so.6	0.00	NA	NA	NA	0.00	NA	NA	NA	2	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
gmx::ForceBuffers::resize(int)	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	2	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
gmx::assign_constraint(gmx::Lincs*, int, int, int, float, float, gmx::ListOfLists<int> const&)	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	2	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
MPIR_Comm_delete_internal	libmpi.so.12.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	2	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
Nbnxm::generateAndFill2DGrid(Nbnxm::Grid, gmx::ArrayRef<Nbnxm::GridWork>, std::vector<int, gmx::Allocator<int, gmx::HostAllocationPolicy> >, float const, float const, gmx::UpdateGroupsCog const, gmx::Range<int>, float, float, ...	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	2	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
ForeignLambdaTerms::addConstantDhdl(FreeEnergyPerturbationCouplingType, double)	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	2	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
gmx::check_grid_jump(long, gmx_domdec_t const, float, gmx_ddbox_t const, bool)	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	2	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
__mpn_divrem	libc.so.6	NA	0.00	NA	0.00	NA	0.00	NA	0.00	NA	1	NA	1	NA	0.00	NA	0.00	NA	0.00	NA	0.00
gmx::setupDomainLifetimeWorkload(t_inputrec const&, t_forcerec const&, pull_t const, gmx_edsam const, t_mdatoms const&, gmx::SimulationWorkload const&)	libgromacs_mpi.so.9.0.0	NA	0.00	NA	0.00	NA	0.00	NA	0.00	NA	1	NA	1	NA	0.00	NA	0.00	NA	0.00	NA	0.00
low_set_ddbox(int, int, int const () [3], float const () [3], bool, gmx::ArrayRef<gmx::BasicVector<float> const>, int const, gmx_ddbox_t)	libgromacs_mpi.so.9.0.0	NA	0.00	NA	0.00	NA	0.00	NA	0.00	NA	1	NA	1	NA	0.00	NA	0.00	NA	0.00	NA	0.00
mkl_serv_free_buffers	libmkl_core.so.2	NA	0.00	NA	0.00	NA	0.00	NA	0.00	NA	1	NA	1	NA	0.00	NA	0.00	NA	0.00	NA	0.00
MPID_Comm_commit_pre_hook	libmpi.so.12.0.0	NA	0.00	NA	0.00	NA	0.00	NA	0.00	NA	1	NA	1	NA	0.00	NA	0.00	NA	0.00	NA	0.00
_IO_fwrite	libc.so.6	NA	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA	1	1	NA	NA	0.00	0.00	NA	NA	0.00	0.00
AtomProxy::residueNumber() const	libgromacs_mpi.so.9.0.0	NA	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA	1	1	NA	NA	0.00	0.00	NA	NA	0.00	0.00
gmx::Constraints::atom2constraints_moltype() const	libgromacs_mpi.so.9.0.0	NA	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA	1	1	NA	NA	0.00	0.00	NA	NA	0.00	0.00
I_MPI_Get_cpu_info	libmpi.so.12.0.0	NA	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA	1	1	NA	NA	0.00	0.00	NA	NA	0.00	0.00
__calloc	libc.so.6	NA	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA	1	1	NA	NA	0.00	0.00	NA	NA	0.00	0.00
extract_bind(t_bin, int, int, double)	libgromacs_mpi.so.9.0.0	NA	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA	1	1	NA	NA	0.00	0.00	NA	NA	0.00	0.00
calc_ewaldcoeff_q(float, float)	libgromacs_mpi.so.9.0.0	NA	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA	1	1	NA	NA	0.00	0.00	NA	NA	0.00	0.00
MPIR_Type_get_true_extent_x_impl	libmpi.so.12.0.0	NA	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA	1	1	NA	NA	0.00	0.00	NA	NA	0.00	0.00
gmx::CommandLineModuleManager::addModuleCMain(char const, char const, int ()(int, char*))	libgromacs_mpi.so.9.0.0	NA	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA	1	1	NA	NA	0.00	0.00	NA	NA	0.00	0.00
gmx::nonbondedMtsFactor(t_inputrec const&)	libgromacs_mpi.so.9.0.0	NA	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA	1	1	NA	NA	0.00	0.00	NA	NA	0.00	0.00
std::vector<float, std::allocator<float> >::_M_default_append(unsigned long)	libgromacs_mpi.so.9.0.0	0.00	0.00	NA	NA	0.00	0.00	NA	NA	1	1	NA	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA
std::vector<gmx::HashedMap<gmx_ga2la_t::Entry>::hashEntry, std::allocator<gmx::HashedMap<gmx_ga2la_t::Entry>::hashEntry> >::_M_default_append(unsigned long)	libgromacs_mpi.so.9.0.0	0.00	0.00	NA	NA	0.00	0.00	NA	NA	1	1	NA	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA
nbnxn_put_on_grid_nonlocal(nonbonded_verlet_t, gmx_domdec_zones_t const, gmx::ArrayRef<long const>, gmx::ArrayRef<gmx::BasicVector<float> const>)	libgromacs_mpi.so.9.0.0	0.00	NA	0.00	NA	0.00	NA	0.00	NA	1	NA	1	NA	0.00	NA	0.00	NA	0.00	NA	0.00	NA
MPIR_Reduce_local	libmpi.so.12.0.0	0.00	NA	0.00	NA	0.00	NA	0.00	NA	1	NA	1	NA	0.00	NA	0.00	NA	0.00	NA	0.00	NA
gmx::LocalTopologyChecker::scheduleCheckOfLocalTopology(int)	libgromacs_mpi.so.9.0.0	0.00	NA	0.00	NA	0.00	NA	0.00	NA	1	NA	1	NA	0.00	NA	0.00	NA	0.00	NA	0.00	NA
gmx_set_thread_affinity(gmx::MDLogger const&, t_commrec const, gmx_hw_opt_t const, gmx::HardwareTopology const&, int, int, int, gmx::IThreadAffinityAccess*)	libgromacs_mpi.so.9.0.0	0.00	NA	0.00	NA	0.00	NA	0.00	NA	1	NA	1	NA	0.00	NA	0.00	NA	0.00	NA	0.00	NA
MPL_wtime_todouble	libmpi.so.12.0.0	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	2	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
__kmpc_serialized_parallel@plt	libomp.so	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	2	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
.omp_outlined.#0x6ad440	libgromacs_mpi.so.9.0.0	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	2	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
init_enxframe(t_enxframe*)	libgromacs_mpi.so.9.0.0	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
gmx::InMemoryDeserializer::reading() const	libgromacs_mpi.so.9.0.0	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	2	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
set_dhdl_output(gmx_enerdata_t*, FreeEnergyPerturbationCouplingType, t_lambda const&)	libgromacs_mpi.so.9.0.0	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	2	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
domdec_zones(gmx_domdec_t*)	libgromacs_mpi.so.9.0.0	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA	1	1	NA	NA	0.00	0.00	NA	NA	0.00	0.00	NA
_IO_default_xsputn	libc.so.6	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA	1	1	NA	NA	0.00	0.00	NA	NA	0.00	0.00	NA
void putAtomsInBoxTemplated<false>(PbcType, float const () [3], float const () [3], gmx::ArrayRef<gmx::BasicVector<float> >, gmx::ArrayRef<gmx::BasicVector<float> >)	libgromacs_mpi.so.9.0.0	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA	1	1	NA	NA	0.00	0.00	NA	NA	0.00	0.00	NA
__tls_get_addr@plt	libomp.so	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA	1	1	NA	NA	0.00	0.00	NA	NA	0.00	0.00	NA
std::vector<float, gmx::Allocator<float, gmx::AlignedAllocationPolicy> >::_M_fill_insert(__gnu_cxx::__normal_iterator<float*, std::vector<float, gmx::Allocator<float, gmx::AlignedAllocationPolicy> > >, unsigned long, float con...	libgromacs_mpi.so.9.0.0	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA	1	1	NA	NA	0.00	0.00	NA	NA	0.00	0.00	NA
.plt.got@start	libmkl_def.so.2	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA	1	1	NA	NA	0.00	0.00	NA	NA	0.00	0.00	NA
__GI___sbrk	libc.so.6	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA	1	1	NA	NA	0.00	0.00	NA	NA	0.00	0.00	NA
dd_dlb_get_should_check_whether_to_turn_dlb_on(gmx_domdec_t*)	libgromacs_mpi.so.9.0.0	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA	1	1	NA	NA	0.00	0.00	NA	NA	0.00	0.00	NA
__kmp_invoke_microtask@plt	libomp.so	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA	1	1	NA	NA	0.00	0.00	NA	NA	0.00	0.00	NA
MPIR_Reduce_intra_redscat_gather	libmpi.so.12.0.0	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA	1	1	NA	NA	0.00	0.00	NA	NA	0.00	0.00	NA
gmx::TrajectoryAnalysisCommandLineRunner::registerModule(gmx::CommandLineModuleManager, char const, char const*, std::function<std::unique_ptr<gmx::TrajectoryAnalysisModule, std::default_delete<gmx::TrajectoryAnalysisModule> > ()> const...	libgromacs_mpi.so.9.0.0	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA	1	1	NA	NA	0.00	0.00	NA	NA	0.00	0.00	NA
gmx::ThreeFry2x64General<20u, 64u>::generateBlock(std::array<unsigned long, 2ul> const&, std::array<unsigned long, 2ul> const&)	libgromacs_mpi.so.9.0.0	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA	1	1	NA	NA	0.00	0.00	NA	NA	0.00	0.00	NA
__kmpc_end_master	libomp.so	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA	1	1	NA	NA	0.00	0.00	NA	NA	0.00	0.00	NA
__kmp_hardware_timestamp	libomp.so	NA	0.00	0.00	NA	NA	0.00	0.00	NA	NA	1	1	NA	NA	0.00	0.00	NA	NA	0.00	0.00	NA
gmx::GammaDistribution<float>::param_type::param_type(float, float)	libgromacs_mpi.so.9.0.0	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	2	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
std::ios_base::Init::Init()	libstdc++.so.6.0.29	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	2	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
nonbonded_verlet_t::dispatchPruneKernelCpu(gmx::InteractionLocality, gmx::ArrayRef<gmx::BasicVector<float> const>) const	libgromacs_mpi.so.9.0.0	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	2	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
gmx_bcast(unsigned long, void*, int)	libgromacs_mpi.so.9.0.0	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	2	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
gmx::CommandLineModuleGroup::addModule(char const*)	libgromacs_mpi.so.9.0.0	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	2	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
gmx::makeLincsDeviations(gmx::Lincs const&, gmx::ArrayRef<gmx::BasicVector<float> const>, t_pbc const*)	libgromacs_mpi.so.9.0.0	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	2	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
amd_erf_zn4	libalm.so	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	2	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
grid_jump_limit(gmx_domdec_comm_t const*, float, int)	libgromacs_mpi.so.9.0.0	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	2	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
mkl_serv_Xbyak::Operand::Operand(int, mkl_serv_Xbyak::Operand::Kind, int, bool)	libmkl_core.so.2	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	2	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
std::_Function_handler<gmx::ObservablesReducerStatus (gmx::ReductionRequirement), gmx::ObservablesReducerBuilder::build()::$_0>::_M_invoke(std::_Any_data const&, gmx::ReductionRequirement&&)	libgromacs_mpi.so.9.0.0	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	2	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
.omp_outlined.#0x66eee0	libgromacs_mpi.so.9.0.0	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	2	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
amd_logf_zn4	libalm.so	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	2	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
.plt.sec@start	libc.so.6	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	2	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
xdrstdio_putint32(XDR, int)	libgromacs_mpi.so.9.0.0	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00
gmx::EnergyOutput::addDataAtEnergyStep(bool, bool, double, float, gmx_enerdata_t const, t_lambda const, float const () [3], gmx::PTCouplingArrays, int, float const () [3], float const () [3], gmx_ekindata_t const, float const*, gmx::Constraints cons...	libgromacs_mpi.so.9.0.0	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00
_dl_map_object	ld-linux-x86-64.so.2	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00
void std::vector<char, std::allocator<char> >::_M_range_insert<char>(__gnu_cxx::__normal_iterator<char, std::vector<char, std::allocator<char> > >, char, char, std::forward_iterator_tag)	libgromacs_mpi.so.9.0.0	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00
open_path	ld-linux-x86-64.so.2	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00
rml::internal::Block::adjustPositionInBin(rml::internal::Bin*)	libiomp5.so	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00
std::vector<std::array<unsigned long, 2ul>, std::allocator<std::array<unsigned long, 2ul> > >::resize(unsigned long)	libgromacs_mpi.so.9.0.0	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00
extractILists(std::array<InteractionList, 94ul> const&, int)	libgromacs_mpi.so.9.0.0	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00
dlopen_doit	libc.so.6	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00
set_ddbox(gmx_domdec_t const&, bool, float const () [3], bool, gmx::ArrayRef<gmx::BasicVector<float> const>, gmx_ddbox_t)	libgromacs_mpi.so.9.0.0	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00
__mmap	ld-linux-x86-64.so.2	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00
std::vector<std::__cxx11::basic_string<char, std::char_traits<char>, std::allocator<char> >, std::allocator<std::__cxx11::basic_string<char, std::char_traits<char>, std::allocator<char> > > >::push_back(std::...	libgromacs_mpi.so.9.0.0	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00
__GI___pthread_mutex_unlock_usercnt	libc.so.6	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00
_intel_fast_memset	libiomp5.so	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00
std::_Rb_tree_insert_and_rebalance(bool, std::_Rb_tree_node_base, std::_Rb_tree_node_base, std::_Rb_tree_node_base&)	libstdc++.so.6.0.32	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00
MPIDI_OFI_mpi_comm_collective_selection_init	libmpi.so.12.0.0	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00
gmx::OptionInfo::OptionInfo(gmx::AbstractOptionStorage*)	libgromacs_mpi.so.9.0.0	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00
gmx::PaddedVector<float, gmx::Allocator<float, gmx::HostAllocationPolicy> >::resizeWithPadding(long)	libgromacs_mpi.so.9.0.0	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00
gmx_omp_nthreads_init(gmx::MDLogger const&, t_commrec*, int, int, int, int, bool)	libgromacs_mpi.so.9.0.0	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00
__kmp_internal_end_library	libiomp5.so	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00
__libm_cbrtf_l9	binary	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00
impi_shm_heap_init	libmpi.so.12.0.0	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00
integratorHasConservedEnergyQuantity(t_inputrec const*)	libgromacs_mpi.so.9.0.0	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00
MPIR_Allreduce_impl_safe	libmpi.so.12.0.0	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00
t_commrec::setDD(std::unique_ptr<gmx_domdec_t, std::default_delete<gmx_domdec_t> >&&)	libgromacs_mpi.so.9.0.0	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00
std::basic_istream<char, std::char_traits<char> >& std::operator>><char, std::char_traits<char>, std::allocator<char> >(std::basic_istream<char, std::char_traits<char> >&, std::__cxx11::basic_string&l...	libstdc++.so.6.0.32	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00
add_bind(t_bin, int, double const)	libgromacs_mpi.so.9.0.0	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00
MPIDI_POSIX_mpi_comm_commit_pre_hook	libmpi.so.12.0.0	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00
__GI___pthread_mutexattr_init	libc.so.6	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00
__GI__IO_un_link.part.0	libc.so.6	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00
MPIR_T_cvar_finalize	libmpi.so.12.0.0	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00
std::filesystem::__cxx11::path::_List::_List()	libstdc++.so.6.0.32	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00
gmx::AbstractOptionStorage::AbstractOptionStorage(gmx::AbstractOption const&, gmx::FlagsTemplate<gmx::OptionFlag>)	libgromacs_mpi.so.9.0.0	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00
KMPNativeAffinity::Mask::is_set(int) const	libiomp5.so	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00
std::__detail::_Prime_rehash_policy::_M_next_bkt(unsigned long) const	libstdc++.so.6.0.32	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00
numa_bitmask_free	libnuma.so.1.0.0	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00
KMPNativeAffinity::Mask::end() const	libiomp5.so	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00
dd_resize_atominfo_and_state(t_forcerec, t_state, int)	libgromacs_mpi.so.9.0.0	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00
__GI___open_catalog	libc.so.6	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00
std::function<gmx::StopSignal ()>& std::vector<std::function<gmx::StopSignal ()>, std::allocator<std::function<gmx::StopSignal ()> > >::emplace_back<std::function<gmx::StopSignal ()> >(std::function<gmx::Sto...	libgromacs_mpi.so.9.0.0	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00
acosf	binary	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00
_itoa_word	libc.so.6	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00
unknown_function	binary	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00
MPIR_T_PVAR_REGISTER_impl	libmpi.so.12.0.0	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00
gmx_reverse_top_t::hasInterAtomicInteractions() const	libgromacs_mpi.so.9.0.0	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00
_dl_new_object	ld-linux-x86-64.so.2	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00
gmx::internal::OptionSectionImpl::findOption(char const*) const	libgromacs_mpi.so.9.0.0	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00
__GI___pthread_self	libc.so.6	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00
__GI___call_tls_dtors	libc.so.6	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00
MPI_Comm_free	libmpi.so.12.0.0	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00
gmx::internal::OptionSectionImpl::finish()	libgromacs_mpi.so.9.0.0	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00
gmx::(anonymous namespace)::ColvarsMDModule::initForceProviders(gmx::ForceProviders*)	libgromacs_mpi.so.9.0.0	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00
MPIDIG_unexp_num	libmpi.so.12.0.0	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00
powf	binary	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00
std::vector<gmx_cgsort, std::allocator<gmx_cgsort> >::resize(unsigned long)	libgromacs_mpi.so.9.0.0	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00
gmx_omp_nthreads_read_env(gmx::MDLogger const&, int*)	libgromacs_mpi.so.9.0.0	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00
mpirinitc_	libmpi.so.12.0.0	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00
nonbonded_verlet_t::getLocalAtomOrder() const	libgromacs_mpi.so.9.0.0	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00
MPIDU_Sched_next_tag	libmpi.so.12.0.0	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00
__cxa_finalize	libc.so.6	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00
MPIR_pmi_virtualization	libmpi.so.12.0.0	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00
nonbonded_verlet_t::setupGpuShortRangeWork(gmx::ListedForcesGpu const*, gmx::InteractionLocality) const	libgromacs_mpi.so.9.0.0	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00
std::vector<float, std::allocator<float> >::resize(unsigned long)	libgromacs_mpi.so.9.0.0	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00
MPIDI_POSIX_mpi_comm_collective_selection_init	libmpi.so.12.0.0	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00
gmx::GpuTaskAssignmentsBuilder::build(gmx::ArrayRef<int const>, gmx::ArrayRef<int const>, gmx_hw_info_t const&, int, gmx::PhysicalNodeCommunicator const&, gmx::TaskTarget, gmx::TaskTarget, gmx::TaskTarget, gmx::TaskTarget, bool, bool, b...	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
nonbonded_verlet_t::setLocalAtomOrder() const	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
__I_MPI___intel_sse2_strncmp	libmpifort.so.12.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
process_and_stopcm_grp(_IO_FILE, t_vcm, t_mdatoms const&, gmx::ArrayRef<gmx::BasicVector<float> >, gmx::ArrayRef<gmx::BasicVector<float> >)	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
gmx_pme_send_parameters(t_commrec const*, interaction_const_t const&, bool, bool, gmx::ArrayRef<float const>, gmx::ArrayRef<float const>, gmx::ArrayRef<float const>, gmx::ArrayRef<float const>, gmx::ArrayRef<float const>, ...	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
_dl_dst_count	ld-linux-x86-64.so.2	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
init_mdoutf(_IO_FILE, int, t_filenm const, gmx::MdrunOptions const&, t_commrec const, gmx::IMDOutputProvider, gmx::MDModulesNotifiers const&, t_inputrec const, gmx_mtop_t const&, gmx_output_env_t const, gmx_wallcycle*, gmx::StartingBehavi...	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
gmx::InMemoryDeserializer::doRvec(float (*) [3])	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
PairlistSets::dispatchPruneKernel(gmx::InteractionLocality, nbnxn_atomdata_t const*, gmx::ArrayRef<gmx::BasicVector<float> const>)	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
__GI___libc_realloc	libc.so.6	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
fft5d_plan_3d(int, int, int, int, int, t_complex, t_complex, t_complex, t_complex*, int, gmx::PinningPolicy) [clone ._omp_fn.0]	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
MPII_Conbc_init	libmpi.so.12.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
make_local_bondeds_excls(gmx_domdec_t const&, gmx_domdec_zones_t const&, gmx_mtop_t const&, gmx::ArrayRef<long const>, bool, int const, bool, float, t_pbc const, gmx::ArrayRef<gmx::BasicVector<float> const>, InteractionDefin...	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
gmx::mdAlgorithmsSetupAtomData(t_commrec const, t_inputrec const&, gmx_mtop_t const&, gmx_localtop_t, t_forcerec, gmx::ForceBuffers, gmx::MDAtoms, gmx::Constraints, gmx::VirtualSitesHandler, gmx_shellfc_t)	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
syscall	libc.so.6	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
t_state::~t_state()	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
MPL_env2bool	libmpi.so.12.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
gmx::InMemoryDeserializer::sourceIsDouble() const	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
gmx::Update::~Update()	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
impi_calloc	libmpi.so.12.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
MPI_Comm_spawn	libmpi.so.12.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
gmx::Constraints::setConstraints(gmx_localtop_t*, int, int, gmx::ArrayRef<float const>, gmx::ArrayRef<float const>, bool, float, gmx::ArrayRef<unsigned short const>)	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
dd_bcast(gmx_domdec_t const, int, void)	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
void std::vector<std::__cxx11::basic_string<char, std::char_traits<char>, std::allocator<char> >, std::allocator<std::__cxx11::basic_string<char, std::char_traits<char>, std::allocator<char> > > >::_M_realloc...	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
wallcycle_have_counter()	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
pme_load_estimate(gmx_mtop_t const&, t_inputrec const&, float const (*) [3])	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
generateEwaldCorrectionTables(int, double, float, double (*)(double, double))	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
void std::vector<std::unique_ptr<gmx::CommandLineModuleGroupData, std::default_delete<gmx::CommandLineModuleGroupData> >, std::allocator<std::unique_ptr<gmx::CommandLineModuleGroupData, std::default_delete<gmx::CommandLineModuleGrou...	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
__btowc	libc.so.6	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
std::vector<nbnxn_ci_t, gmx::DefaultInitializationAllocator<nbnxn_ci_t, std::allocator<nbnxn_ci_t> > >::_M_default_append(unsigned long)	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
gmx::DomainDecompositionBuilder::Impl::build(gmx::LocalAtomSetManager, gmx_localtop_t const&, t_state const&, gmx::ObservablesReducerBuilder)	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
gmx::Constraints::Impl::setConstraints(gmx_localtop_t*, int, int, gmx::ArrayRef<float const>, gmx::ArrayRef<float const>, bool, float, gmx::ArrayRef<unsigned short const>)	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
dd_cutoff_twobody(gmx_domdec_t const*)	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
gmx::FileNameOptionManager::FileNameOptionManager()	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
mdoutf_tng_close(gmx_mdoutf*)	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
_ZNSt11__timepunctIcEC1EPSt17__timepunct_cacheIcEm@plt	libstdc++.so.6.0.32	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
numa_bitmask_setbit	libnuma.so.1.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
void ddSendrecv<float>(gmx_domdec_t const*, int, int, gmx::ArrayRef<float>, gmx::ArrayRef<float>)	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
gmx::SelectionParserSymbolIterator::operator==(gmx::SelectionParserSymbolIterator const&) const	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
__GI___readdir64	libc.so.6	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
impi_shm_create	libmpi.so.12.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
gmx::makeLincsDeviations(gmx::Lincs const&, gmx::ArrayRef<gmx::BasicVector<float> const>, t_pbc const*) [clone .isra.0]	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
gmx::FloatOptionStorage::optionInfo()	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
frexpf	libm.so.6	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
clear_dd_cycle_counts(gmx_domdec_t*)	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
gmx::makeUpdateGroupingsPerMoleculeType(gmx_moltype_t const&, gmx::ArrayRef<t_iparams const>)	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
std::_Rb_tree<std::__cxx11::basic_string<char, std::char_traits<char>, std::allocator<char> >, std::pair<std::__cxx11::basic_string<char, std::char_traits<char>, std::allocator<char> > const, gmx::KeyValueTreeValue...	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
MPIR_Allgather_intra_brucks	libmpi.so.12.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
count_bonded_distances(gmx_mtop_t const&, t_inputrec const&, double, double)	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
__brk	libc.so.6	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
dd_cutoff_multibody(gmx_domdec_t const*)	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
inputrecFrozenAtoms(t_inputrec const*)	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
search_cache	ld-linux-x86-64.so.2	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
_IO_str_init_static_internal	libc.so.6	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
void std::vector<nbnxn_cj_t, gmx::DefaultInitializationAllocator<nbnxn_cj_t, std::allocator<nbnxn_cj_t> > >::_M_realloc_insert<nbnxn_cj_t const&>(__gnu_cxx::__normal_iterator<nbnxn_cj_t*, std::vector<nbnxn_cj_t, gmx::Defau...	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
__memcpy_chk_ifunc	libc.so.6	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
std::filesystem::__cxx11::path::_M_split_cmpts()	libstdc++.so.6.0.32	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
std::vector<float, gmx::Allocator<float, gmx::HostAllocationPolicy> >::_M_fill_insert(__gnu_cxx::__normal_iterator<float*, std::vector<float, gmx::Allocator<float, gmx::HostAllocationPolicy> > >, unsigned long, float const&am...	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
gmx::InMemoryDeserializer::doUShort(unsigned short*)	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
std::_Rb_tree<unsigned char, std::pair<unsigned char const, void ()(gmx::KeyValueTreeValueBuilder, gmx::ISerializer)>, std::_Select1st<std::pair<unsigned char const, void ()(gmx::KeyValueTreeValueBuilder, gmx::ISerializer)> >, st...	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
gmx::AbstractOptionStorage::finish()	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
gmx::EnumOptionStorage::~EnumOptionStorage()	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
gmx::(anonymous namespace)::detectCpuLimit(std::__cxx11::basic_string<char, std::char_traits<char>, std::allocator<char> > const&)	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
surface_frac(int, float, float)	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
__strsep	ld-linux-x86-64.so.2	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
impi_shm_get_number_of_l3_caches	libmpi.so.12.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
Nbnxm::Grid::setCellIndices(int, int, Nbnxm::GridSetData, gmx::ArrayRef<Nbnxm::GridWork>, gmx::Range<int>, gmx::ArrayRef<long const>, gmx::ArrayRef<gmx::BasicVector<float> const>, int, nbnxn_atomdata_t) [clone ._omp_fn.0]	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
dd_pme_maxshift_y(gmx_domdec_t const&)	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
gmx::SelectionParserSymbolTable::Impl::addSymbol(std::unique_ptr<gmx::SelectionParserSymbol, std::default_delete<gmx::SelectionParserSymbol> >)	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
_GLOBAL__sub_I_densityfittingforceprovider.cpp	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
mkl_serv_load_thread_fun	libmkl_core.so.2	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
MPIDI_SHMGR_Gather_reduce	libmpi.so.12.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
gmx::CommandLineModuleSettings::setDefaultNiceLevel(int)	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
mkl_dft_def_ippsFFTFwd_RToPerm_32f@plt	libmkl_def.so.2	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
gmx::LocalAtomSetManager::~LocalAtomSetManager()	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
inputrecNptTrotter(t_inputrec const*)	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
gmx_domdec_comm_t::~gmx_domdec_comm_t()	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
std::vector<gmx::BasicVector<float>, gmx::Allocator<gmx::BasicVector<float>, gmx::AlignedAllocationPolicy> >::_M_fill_insert(__gnu_cxx::__normal_iterator<gmx::BasicVector<float>*, std::vector<gmx::BasicVector<float>...	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
dd_pme_maxshift_x(gmx_domdec_t const&)	libgromacs_mpi.so.9.0.0	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA
std::__cxx11::basic_string<char, std::char_traits<char>, std::allocator<char> >::compare(char const*) const	libstdc++.so.6.0.29	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
mkl_serv_get_envmode_variable@plt	libmkl_core.so.2	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
std::vector<float, gmx::Allocator<float, gmx::AlignedAllocationPolicy> >::_M_default_append(unsigned long)	libgromacs_mpi.so.9.0.0	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
__GI___strtol_internal	libc.so.6	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
std::filesystem::__cxx11::filesystem_error::~filesystem_error()	libstdc++.so.6.0.29	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
MPIR_Get_contextid_sparse_group	libmpi.so.12.0.0	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
void gmx::changePinningPolicy<std::vector<int, gmx::Allocator<int, gmx::HostAllocationPolicy> > >(std::vector<int, gmx::Allocator<int, gmx::HostAllocationPolicy> >*, gmx::PinningPolicy)	libgromacs_mpi.so.9.0.0	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
std::vector<float, gmx::Allocator<float, gmx::HostAllocationPolicy> >::reserve(unsigned long)	libgromacs_mpi.so.9.0.0	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
gmx::DomainDecompositionBuilder::Impl::Impl(gmx::MDLogger const&, t_commrec, gmx::DomdecOptions const&, gmx::MdrunOptions const&, gmx_mtop_t const&, t_inputrec const&, gmx::MDModulesNotifiers const&, float const () [3], gmx::Array...	libgromacs_mpi.so.9.0.0	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
MPID_Comm_get_lpid	libmpi.so.12.0.0	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
std::_Rb_tree_increment(std::_Rb_tree_node_base const*)	libstdc++.so.6.0.29	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
std::__detail::_Prime_rehash_policy::_M_next_bkt(unsigned long) const	libstdc++.so.6.0.29	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
cbrt	libm.so.6	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
MPIDI_comm_create_rank_map	libmpi.so.12.0.0	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
MPIR_Type_get_true_extent_impl	libmpi.so.12.0.0	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
gmx::InsertMoleculesInfo::name()	libgromacs_mpi.so.9.0.0	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
v_q_ewald_lr(double, double)	libgromacs_mpi.so.9.0.0	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
MPIDI_Coll_selection_get_codename_and_fabric	libmpi.so.12.0.0	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
gmx_moltype_t::~gmx_moltype_t()	libgromacs_mpi.so.9.0.0	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
__I_MPI___intel_avx_rep_memset	libmpifort.so.12.0.0	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
dfs_traversal.part.0	ld-linux-x86-64.so.2	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
MPIR_Type_commit	libmpi.so.12.0.0	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
MPIR_T_cvar_init	libmpi.so.12.0.0	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
std::vector<int, gmx::Allocator<int, gmx::HostAllocationPolicy> >::vector(std::vector<int, gmx::Allocator<int, gmx::HostAllocationPolicy> >&&, gmx::Allocator<int, gmx::HostAllocationPolicy> const&, std::integral_co...	libgromacs_mpi.so.9.0.0	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
MPIC_Wait	libmpi.so.12.0.0	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
gmx::MDAtoms::resizeChargeA(int)	libgromacs_mpi.so.9.0.0	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
gmx_mtop_interaction_count(gmx_mtop_t const&, unsigned int)	libgromacs_mpi.so.9.0.0	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
__I_MPI___intel_sse2_strcpy	libmpifort.so.12.0.0	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
.omp_outlined.#0x5f4ef0	libgromacs_mpi.so.9.0.0	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
ListedForces::~ListedForces()	libgromacs_mpi.so.9.0.0	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
memset@plt	libomp.so	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
__I_MPI__intel_fast_memset	libmpifort.so.12.0.0	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
MPIR_Bcast_intra_kary	libmpi.so.12.0.0	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
KMPNativeAffinity::Mask::next(int) const	libomp.so	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
strlen_ifunc	libc.so.6	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
__GI__dl_catch_error	libc.so.6	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
gmx::OptionStorageTemplate<std::__cxx11::basic_string<char, std::char_traits<char>, std::allocator<char> > >::setDefaultValue(std::__cxx11::basic_string<char, std::char_traits<char>, std::allocator<char> > const&am...	libgromacs_mpi.so.9.0.0	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
MPIR_Comm_group_impl	libmpi.so.12.0.0	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
__mpn_lshift	libc.so.6	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
__GI___fstat64	libc.so.6	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
MPID_Get_node_id	libmpi.so.12.0.0	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
mkl_dft_def_ownscDftInv_Prime8_32fc@plt	libmkl_def.so.2	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
std::pair<std::_Rb_tree_iterator<std::pair<std::__cxx11::basic_string<char, std::char_traits<char>, std::allocator<char> > const, std::unique_ptr<gmx::AbstractOptionStorage, std::default_delete<gmx::AbstractOptionStorage>...	libgromacs_mpi.so.9.0.0	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
malloc@plt	libomp.so	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
impi_realloc	libmpi.so.12.0.0	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
__kmp_stg_print_allocator(kmp_str_buf, char const, void*)	libomp.so	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
MPI_Finalize	libmpi.so.12.0.0	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
strlen	ld-linux-x86-64.so.2	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
std::__detail::_Prime_rehash_policy::_M_need_rehash(unsigned long, unsigned long, unsigned long) const	libstdc++.so.6.0.29	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
pme_loadbal_do(pme_load_balancing_t, t_commrec, _IO_FILE, _IO_FILE, gmx::MDLogger const&, t_inputrec const&, t_forcerec, float const () [3], gmx::ArrayRef<gmx::BasicVector<float> const>, gmx_wallcycle, long, long, bool, bool)	libgromacs_mpi.so.9.0.0	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
std::__cxx11::basic_string<char, std::char_traits<char>, std::allocator<char> >::_M_append(char const*, unsigned long)	libstdc++.so.6.0.29	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
__mempcpy_avx512_unaligned_erms	libc.so.6	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
__kmpc_reduce_nowait	libomp.so	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
__kmp_stg_cmp(void const, void const)	libomp.so	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
std::__cxx11::basic_string<char, std::char_traits<char>, std::allocator<char> >* std::__uninitialized_copy<false>::__uninit_copy<std::__cxx11::basic_string<char, std::char_traits<char>, std::allocator<char> > co...	libgromacs_mpi.so.9.0.0	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
__posix_memalign	libc.so.6	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
__kmpc_end_reduce_nowait	libomp.so	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
_GLOBAL__sub_I_bonded.cpp	libgromacs_mpi.so.9.0.0	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
gmx::OptionValueStorePlain<int>::~OptionValueStorePlain()	libgromacs_mpi.so.9.0.0	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
gmx::Update::updateAfterPartition(int, gmx::ArrayRef<unsigned short const>, gmx::ArrayRef<unsigned short const>, gmx::ArrayRef<unsigned short const>)	libgromacs_mpi.so.9.0.0	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
clear_fshift(float*)	libgromacs_mpi.so.9.0.0	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
__GI___uflow	libc.so.6	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
dd_make_reverse_top(_IO_FILE, gmx_domdec_t, gmx_mtop_t const&, gmx::VirtualSitesHandler const*, t_inputrec const&, gmx::DDBondedChecking)	libgromacs_mpi.so.9.0.0	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
.omp_outlined..19	libgromacs_mpi.so.9.0.0	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA	NA
MPIR_Type_create_pairtype	libmpi.so.12.0.0	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
f_calc_vir(int, int, float const () [3], float const () [3], float () [3], float const () [3])	libgromacs_mpi.so.9.0.0	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
amd_log_zn4	libalm.so	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
gmx::SelectionParserSymbolIterator::operator++()	libgromacs_mpi.so.9.0.0	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
@plt_start@	libalm.so	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
gmx::AbstractCompositeHelpTopic::AbstractCompositeHelpTopic()	libgromacs_mpi.so.9.0.0	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
__kmp_itt_init_ittlib	libomp.so	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
__mpn_cmp	libc.so.6	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
gmx::InMemorySerializer::doInt(int*)	libgromacs_mpi.so.9.0.0	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
write_hconf_mtop(_IO_FILE, char const, gmx_mtop_t const&, float const () [3], float const () [3], float const (*) [3])	libgromacs_mpi.so.9.0.0	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
__I_MPI___intel_sse2_strchr	libmpifort.so.12.0.0	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
__kmpc_end_serialized_parallel@plt	libomp.so	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
__GI___libc_write	libc.so.6	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
MPIU_Selection_init	libmpi.so.12.0.0	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
std::_Function_handler<void (long), gmx::LocalTopologyChecker::LocalTopologyChecker(gmx::MDLogger const&, t_commrec const*, gmx_mtop_t const&, gmx::DDBondedChecking, gmx_localtop_t const&, t_state const&, bool, gmx::ObservablesReducerBui...	libgromacs_mpi.so.9.0.0	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
free@plt	libomp.so	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
MPII_CommL_remember	libmpi.so.12.0.0	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
_IO_old_init	libc.so.6	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
memcpy	ld-linux-x86-64.so.2	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
_dl_map_object_from_fd	ld-linux-x86-64.so.2	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
gmx::decideWhetherToUseGpusForPme(bool, gmx::TaskTarget, gmx::TaskTarget, std::vector<int, std::allocator<int> > const&, t_inputrec const&, int, int, bool)	libgromacs_mpi.so.9.0.0	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
_IO_sputbackc	libc.so.6	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
std::_Rb_tree<std::__cxx11::basic_string<char, std::char_traits<char>, std::allocator<char> >, std::pair<std::__cxx11::basic_string<char, std::char_traits<char>, std::allocator<char> > const, std::unique_ptr<gmx...	libgromacs_mpi.so.9.0.0	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
nbnxn_atomdata_t::resizeCoordinateBuffer(int)	libgromacs_mpi.so.9.0.0	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
__kmp_cleanup_indirect_user_locks	libomp.so	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
_GLOBAL__sub_I_qmmminputgenerator.cpp	libgromacs_mpi.so.9.0.0	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
gmx::Update::Impl::~Impl()	libgromacs_mpi.so.9.0.0	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
MPIU_Selection_get_container	libmpi.so.12.0.0	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
__GI__dl_find_dso_for_object	ld-linux-x86-64.so.2	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
__GI___fstatat	libc.so.6	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
MPIR_BAND_check_dtype	libmpi.so.12.0.0	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
std::_Rb_tree<std::type_index, std::pair<std::type_index const, std::function<long (gmx::Any const&)> >, std::_Select1st<std::pair<std::type_index const, std::function<long (gmx::Any const&)> > >, std::less<std::...	libgromacs_mpi.so.9.0.0	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
gmx::SelectionParserSymbolTable::addMethod(char const, gmx_ana_selmethod_t)	libgromacs_mpi.so.9.0.0	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
strcmp@plt	libomp.so	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
std::vector<float, gmx::Allocator<float, gmx::AlignedAllocationPolicy> >::reserve(unsigned long)	libgromacs_mpi.so.9.0.0	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
mkl_serv_cpu_detect@plt	libmkl_core.so.2	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
gmx::AbstractOptionSectionHandle::addOptionImpl(gmx::AbstractOption const&)	libgromacs_mpi.so.9.0.0	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
amd_cbrtf_zn4	libalm.so	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
MPIR_T_cat_add_subcat	libmpi.so.12.0.0	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
forcerec_set_ranges(t_forcerec*, int, int, int)	libgromacs_mpi.so.9.0.0	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
increaseNstlist(_IO_FILE, t_commrec, t_inputrec, int, gmx_mtop_t const, float const (*) [3], float, bool, gmx::CpuInfo const&)	libgromacs_mpi.so.9.0.0	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
gmx::(anonymous namespace)::ValueSerializer::initSerializers()	libgromacs_mpi.so.9.0.0	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
MPIR_Localcopy	libmpi.so.12.0.0	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
dd_cell_sizes_dlb_root_enforce_limits(gmx_domdec_t, int, int, RowCoordinator, gmx_ddbox_t const, bool, long, float, int)	libgromacs_mpi.so.9.0.0	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
MPIR_Get_contextid_sparse	libmpi.so.12.0.0	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
_GLOBAL__sub_I_colvar.cpp	libgromacs_mpi.so.9.0.0	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
get_ebin_space(t_ebin, int, char const const, char const)	libgromacs_mpi.so.9.0.0	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
__GI___read_nocancel	ld-linux-x86-64.so.2	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
mkl_serv_trylock	libmkl_core.so.2	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
gmx::Options::Options()	libgromacs_mpi.so.9.0.0	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
_Init_MKL_Loader	libmkl_intel_lp64.so.2	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA
std::vector<gmx_cgsort, std::allocator<gmx_cgsort> >::_M_default_append(unsigned long)	libgromacs_mpi.so.9.0.0	NA	NA	0.00	NA	NA	NA	0.00	NA	NA	NA	1	NA	NA	NA	0.00	NA	NA	NA	0.00	NA

	gcc	aocc	aocc-libalm	icx
Uncheck all modules
libgromacs_mpi.so.9.0.0	47.423505642641 %	32.16042671143 %	32.126841183693 %	37.473315929877 %
libmpi.so.12.0.0	33.545544410954 %	31.958999481154 %	32.806001287667 %	34.374273382215 %
libm.so.6	16.541421007205 %	20.187269801187 %	10.865676674992 %
libmkl_def.so.2	1.9346080811083 %	1.6426602215797 %	1.6406008714548 %	2.0946642731287 %
libc.so.6	0.22494292752526 %	0.16801931125519 %	0.16242988222803 %	0.042973089628504 %
ld-linux-x86-64.so.2	0.040414845352644 %	0.054547457169974 %	0.061548843426862 %	0.056309275678359 %
libmkl_intel_lp64.so.2	0.04830133006908 %	0.036028567497851 %	0.032914127412369 %	0.045090282452293 %
libgomp.so.1.0.0	0.15712476579938 %
libmpifort.so.12.0.0	0.040415042007225 %	0.036533582606353 %	0.031103791086935 %	0.038951034308412 %
libmkl_core.so.2	0.010054589569336 %	0.0092595564201474 %	0.0078992741182446 %	0.0080441376194358 %
libstdc++.so.6.0.32	0.0011828636052087 %
[vdso]	0.00039431298500858 %	0.00016835947462823 %
libmkl_sequential.so.2	0.00019715764210559 %
libnuma.so.1.0.0	0.00019714390509762 %
libomp.so
binary
libiomp5.so
libalm.so
libstdc++.so.6.0.29

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