| Name | Module | Coverage run_0 (%) | Coverage Excluding Loops run_0 (%) | Max Inclusive Time Over Threads run_0 (s) | Max Exclusive Time Over Threads run_0 (s) | Inclusive Time w.r.t. Wall Time run_0 (s) | Exclusive Time w.r.t. Wall Time run_0 (s) | Nb Threads run_0 | Deviation (coverage) run_0 | Deviation (walltime) run_0 | Categories run_0 | Compilation Options |
|---|---|---|---|---|---|---|---|---|---|---|---|---|
| ►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 | 18.98 | 0.00 | 5.04 | 0.01 | 2.95 | 0.00 | 128 | 2.23 | 0.35 | /home/eoseret/gromacs-2024.2/install_MPI/lib64/libgromacs_mpi.so.9.0.0 (%): 100.00 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 --driver-mode=g++ -D GMX_DOUBLE=0 -D HAVE_CONFIG_H -D TMPI_EXPORTS -D TMPI_USE_VISIBILITY -D USE_STD_INTTYPES_H -D libgromacs_EXPORTS -I /home/eoseret/g... |
| ►Loop 834 - simd_kernel.h:273-545 - libgromacs_mpi.so.9.0.0 [...] | 18.98 | 0.81 | 9.31 | 0.26 | 2.95 | 0.13 | 128 | 0.23 | 0.04 | |||
| ○Loop 835 - simd_kernel.h:518-518 - libgromacs_mpi.so.9.0.0 [...] | 0.36 | 0.36 | 0.60 | 0.60 | 0.06 | 0.06 | 53 | 1.25 | 0.19 | |||
| ○Loop 836 - simd_kernel.h:510-513 - libgromacs_mpi.so.9.0.0 [...] | 0.04 | 0.04 | 0.08 | 0.08 | 0.01 | 0.01 | 36 | 0.14 | 0.02 | |||
| ○Loop 838 - impl_x86_avx_512_simd_float.h:70-461 - libgromacs_mpi.so.9.0.0 [...] | 0.41 | 0.41 | 0.31 | 0.31 | 0.06 | 0.06 | 115 | 0.50 | 0.08 | |||
| ○Loop 839 - simd_kernel.h:476-476 - libgromacs_mpi.so.9.0.0 [...] | 12.31 | 12.31 | 4.55 | 4.55 | 1.92 | 1.92 | 128 | 7.42 | 1.15 | |||
| ○Loop 837 - simd_kernel.h:497-497 - libgromacs_mpi.so.9.0.0 [...] | 4.54 | 4.54 | 3.20 | 3.20 | 0.71 | 0.71 | 128 | 5.54 | 0.86 | |||
| ○Loop 840 - impl_x86_avx_512_simd_float.h:70-461 - libgromacs_mpi.so.9.0.0 [...] | 0.52 | 0.52 | 0.32 | 0.32 | 0.08 | 0.08 | 128 | 0.33 | 0.05 | |||
| ○ADIOI_GEN_SetLockDirect64 | libmpi.so.12.0.0 | 15.02 | 15.02 | 4.32 | 4.32 | 2.34 | 2.34 | 192 | 7.59 | 1.17 | MPI (%): 100.00 | |
| ○f64xsubf128 | libm.so.6 | 11.02 | 11.02 | 2.32 | 2.32 | 1.72 | 1.72 | 192 | 2.65 | 0.41 | Math (%): 100.00 | |
| ○MPIDI_SHMGR_Gather | libmpi.so.12.0.0 | 9.72 | 0.00 | 3.11 | 0.00 | 1.51 | 0.00 | 192 | 7.19 | 1.11 | MPI (%): 100.00 | |
| ○energyDriftAtomPair(bool, bool, float, float, float, float, pot_derivatives_t const*) | libgromacs_mpi.so.9.0.0 | 9.08 | 9.08 | 1.86 | 1.86 | 1.41 | 1.41 | 192 | 2.07 | 0.32 | /home/eoseret/gromacs-2024.2/install_MPI/lib64/libgromacs_mpi.so.9.0.0 (%): 100.00 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 --driver-mode=g++ -D GMX_DOUBLE=0 -D HAVE_CONFIG_H -D TMPI_EXPORTS -D TMPI_USE_VISIBILITY -D USE_STD_INTTYPES_H -D libgromacs_EXPORTS -I /home/eoseret/g... |
| ○erfcf | libm.so.6 | 7.92 | 7.92 | 1.63 | 1.63 | 1.23 | 1.23 | 192 | 1.90 | 0.29 | Math (%): 100.00 | |
| ►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 | 3.34 | 0.00 | 0.99 | 0.00 | 0.52 | 0.00 | 128 | 0.50 | 0.08 | /home/eoseret/gromacs-2024.2/install_MPI/lib64/libgromacs_mpi.so.9.0.0 (%): 100.00 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 --driver-mode=g++ -D GMX_DOUBLE=0 -D HAVE_CONFIG_H -D TMPI_EXPORTS -D TMPI_USE_VISIBILITY -D USE_STD_INTTYPES_H -D libgromacs_EXPORTS -I /home/eoseret/g... |
| ►Loop 841 - simd_kernel.h:273-555 - libgromacs_mpi.so.9.0.0 [...] | 3.34 | 0.10 | 1.76 | 0.05 | 0.52 | 0.02 | 128 | 0.06 | 0.01 | |||
| ○Loop 843 - simd_kernel.h:510-513 - libgromacs_mpi.so.9.0.0 [...] | 0.01 | 0.01 | 0.02 | 0.02 | 0.00 | 0.00 | 19 | 0.03 | 0.01 | |||
| ○Loop 842 - simd_kernel.h:518-518 - libgromacs_mpi.so.9.0.0 [...] | 0.05 | 0.05 | 0.08 | 0.08 | 0.01 | 0.01 | 38 | 0.16 | 0.03 | |||
| ○Loop 847 - impl_x86_avx_512_simd_float.h:70-461 - libgromacs_mpi.so.9.0.0 [...] | 0.09 | 0.09 | 0.05 | 0.05 | 0.01 | 0.01 | 121 | 0.08 | 0.01 | |||
| ○Loop 844 - simd_kernel.h:497-497 - libgromacs_mpi.so.9.0.0 [...] | 0.82 | 0.82 | 0.60 | 0.60 | 0.13 | 0.13 | 126 | 1.01 | 0.16 | |||
| ○Loop 846 - simd_kernel.h:476-476 - libgromacs_mpi.so.9.0.0 [...] | 2.20 | 2.20 | 0.88 | 0.88 | 0.34 | 0.34 | 128 | 1.38 | 0.21 | |||
| ○Loop 845 - impl_x86_avx_512_simd_float.h:70-461 - libgromacs_mpi.so.9.0.0 [...] | 0.07 | 0.07 | 0.06 | 0.06 | 0.01 | 0.01 | 101 | 0.10 | 0.02 | |||
| ►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 | 3.28 | 0.00 | 0.74 | 0.00 | 0.51 | 0.00 | 192 | 0.78 | 0.12 | /home/eoseret/gromacs-2024.2/install_MPI/lib64/libgromacs_mpi.so.9.0.0 (%): 100.00 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 --driver-mode=g++ -D GMX_DOUBLE=0 -D HAVE_CONFIG_H -D TMPI_EXPORTS -D TMPI_USE_VISIBILITY -D USE_STD_INTTYPES_H -D libgromacs_EXPORTS -I /home/eoseret/g... |
| ►Loop 14220 - calc_verletbuf.cpp:606-849 - libgromacs_mpi.so.9.0.0 [...] | 3.28 | 0.05 | 0.75 | 0.03 | 0.51 | 0.01 | 149 | 0.04 | 0.01 | |||
| ○Loop 14221 - calc_verletbuf.cpp:606-849 - libgromacs_mpi.so.9.0.0 [...] | 3.24 | 3.24 | 0.72 | 0.72 | 0.50 | 0.50 | 192 | 0.76 | 0.12 | |||
| ○MPIR_Progress_hook_exec_on_vci | libmpi.so.12.0.0 | 2.74 | 2.74 | 0.84 | 0.84 | 0.43 | 0.43 | 192 | 1.37 | 0.21 | MPI (%): 100.00 | |
| ○MPID_Progress_wait | libmpi.so.12.0.0 | 1.44 | 1.44 | 0.47 | 0.47 | 0.22 | 0.22 | 192 | 0.71 | 0.11 | MPI (%): 100.00 | |
| ►gather_f_bsplines(gmx_pme_t const*, float const*, bool, PmeAtomComm const*, splinedata_t const*, float) | libgromacs_mpi.so.9.0.0 | 1.30 | 0.00 | 0.84 | 0.01 | 0.20 | 0.00 | 64 | 0.59 | 0.09 | /home/eoseret/gromacs-2024.2/install_MPI/lib64/libgromacs_mpi.so.9.0.0 (%): 100.00 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 --driver-mode=g++ -D GMX_DOUBLE=0 -D HAVE_CONFIG_H -D TMPI_EXPORTS -D TMPI_USE_VISIBILITY -D USE_STD_INTTYPES_H -D libgromacs_EXPORTS -I /home/eoseret/g... |
| ►Loop 17265 - pme_gather.cpp:103-348 - libgromacs_mpi.so.9.0.0 [...] | 1.30 | 1.30 | 0.84 | 0.84 | 0.20 | 0.20 | 64 | 0.59 | 0.09 | |||
| ○Loop 17264 - pme_gather.cpp:247-260 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 17267 - pme_gather.cpp:103-124 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 17268 - pme_gather.cpp:109-124 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17266 - pme_gather.cpp:116-120 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17269 - pme_gather.cpp:116-120 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►fft5d_execute(fft5d_plan_t*, int, gmx_wallcycle*) | libgromacs_mpi.so.9.0.0 | 1.29 | 0.00 | 0.75 | 0.01 | 0.20 | 0.00 | 64 | 0.38 | 0.06 | /home/eoseret/gromacs-2024.2/install_MPI/lib64/libgromacs_mpi.so.9.0.0 (%): 100.00 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 --driver-mode=g++ -D GMX_DOUBLE=0 -D HAVE_CONFIG_H -D TMPI_EXPORTS -D TMPI_USE_VISIBILITY -D USE_STD_INTTYPES_H -D libgromacs_EXPORTS -I /home/eoseret/g... |
| ►Loop 17631 - wallcycle.h:391-498 - libgromacs_mpi.so.9.0.0 [...] | 1.29 | 0.01 | 1.19 | 0.02 | 0.20 | 0.00 | 48 | 0.03 | 0.00 | |||
| ►Loop 17632 - fft5d.cpp:887-918 - libgromacs_mpi.so.9.0.0 [...] | 0.26 | 0.00 | 0.28 | 0.01 | 0.04 | 0.00 | 18 | 0.01 | 0.00 | |||
| ►Loop 17633 - fft5d.cpp:908-918 - libgromacs_mpi.so.9.0.0 | 0.25 | 0.01 | 0.27 | 0.01 | 0.04 | 0.00 | 38 | 0.02 | 0.00 | |||
| ○Loop 17637 - fft5d.cpp:916-918 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.01 | 0.01 | 0.00 | 0.00 | 8 | 0.02 | 0.00 | |||
| ►Loop 17634 - fft5d.cpp:912-918 - libgromacs_mpi.so.9.0.0 | 0.24 | 0.01 | 0.24 | 0.02 | 0.04 | 0.00 | 38 | 0.03 | 0.00 | |||
| ○Loop 17635 - fft5d.cpp:916-918 - libgromacs_mpi.so.9.0.0 | 0.10 | 0.10 | 0.12 | 0.12 | 0.02 | 0.02 | 64 | 0.11 | 0.02 | |||
| ○Loop 17636 - fft5d.cpp:916-918 - libgromacs_mpi.so.9.0.0 | 0.13 | 0.13 | 0.10 | 0.10 | 0.02 | 0.02 | 64 | 0.12 | 0.02 | |||
| ►Loop 17644 - fft5d.cpp:758-789 - libgromacs_mpi.so.9.0.0 [...] | 0.54 | 0.01 | 0.44 | 0.02 | 0.08 | 0.00 | 36 | 0.03 | 0.00 | |||
| ►Loop 17645 - fft5d.cpp:779-789 - libgromacs_mpi.so.9.0.0 | 0.53 | 0.03 | 0.42 | 0.04 | 0.08 | 0.00 | 57 | 0.04 | 0.01 | |||
| ►Loop 17646 - fft5d.cpp:783-789 - libgromacs_mpi.so.9.0.0 | 0.50 | 0.03 | 0.34 | 0.04 | 0.08 | 0.00 | 56 | 0.04 | 0.01 | |||
| ○Loop 17647 - fft5d.cpp:787-789 - libgromacs_mpi.so.9.0.0 | 0.22 | 0.22 | 0.14 | 0.14 | 0.03 | 0.03 | 64 | 0.13 | 0.02 | |||
| ○Loop 17648 - fft5d.cpp:787-789 - libgromacs_mpi.so.9.0.0 | 0.25 | 0.25 | 0.16 | 0.16 | 0.04 | 0.04 | 64 | 0.13 | 0.02 | |||
| ○Loop 17649 - fft5d.cpp:787-789 - libgromacs_mpi.so.9.0.0 | 0.01 | 0.01 | 0.04 | 0.04 | 0.00 | 0.00 | 8 | 0.07 | 0.01 | |||
| ►Loop 17638 - fft5d.cpp:823-855 - libgromacs_mpi.so.9.0.0 [...] | 0.48 | 0.00 | 0.45 | 0.01 | 0.07 | 0.00 | 17 | 0.01 | 0.00 | |||
| ►Loop 17639 - fft5d.cpp:845-855 - libgromacs_mpi.so.9.0.0 | 0.48 | 0.01 | 0.44 | 0.01 | 0.07 | 0.00 | 27 | 0.02 | 0.00 | |||
| ►Loop 17640 - fft5d.cpp:849-855 - libgromacs_mpi.so.9.0.0 | 0.47 | 0.13 | 0.42 | 0.11 | 0.07 | 0.02 | 64 | 0.13 | 0.02 | |||
| ○Loop 17643 - fft5d.cpp:855-855 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17642 - fft5d.cpp:853-855 - libgromacs_mpi.so.9.0.0 | 0.01 | 0.01 | 0.08 | 0.08 | 0.00 | 0.00 | 8 | 0.11 | 0.02 | |||
| ○Loop 17641 - fft5d.cpp:853-855 - libgromacs_mpi.so.9.0.0 | 0.33 | 0.33 | 0.23 | 0.23 | 0.05 | 0.05 | 64 | 0.17 | 0.03 | |||
| ►.omp_outlined..2 | libgromacs_mpi.so.9.0.0 | 1.16 | 0.00 | 0.73 | 0.01 | 0.18 | 0.00 | 64 | 0.49 | 0.08 | /home/eoseret/gromacs-2024.2/install_MPI/lib64/libgromacs_mpi.so.9.0.0 (%): 100.00 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 --driver-mode=g++ -D GMX_DOUBLE=0 -D HAVE_CONFIG_H -D TMPI_EXPORTS -D TMPI_USE_VISIBILITY -D USE_STD_INTTYPES_H -D libgromacs_EXPORTS -I /home/eoseret/g... |
| ►Loop 17540 - pme_spread.cpp:188-990 - libgromacs_mpi.so.9.0.0 [...] | 1.16 | 0.00 | 0.77 | 0.00 | 0.18 | 0.00 | 7 | 0.00 | 0.00 | |||
| ►Loop 17541 - pme_spread.cpp:439-447 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 17542 - pme_spread.cpp:441-447 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17546 - pme_spread.cpp:445-447 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17544 - pme_spread.cpp:445-447 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17545 - pme_spread.cpp:445-447 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17543 - pme_spread.cpp:445-447 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 17547 - pme_spread.cpp:358-400 - libgromacs_mpi.so.9.0.0 [...] | 0.70 | 0.70 | 0.45 | 0.45 | 0.11 | 0.11 | 64 | 0.34 | 0.05 | |||
| ►Loop 17548 - pme_spread.cpp:400-400 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 17549 - pme_spread.cpp:400-400 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17551 - pme_spread.cpp:400-400 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17553 - pme_spread.cpp:400-400 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17552 - pme_spread.cpp:400-400 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17550 - pme_spread.cpp:400-400 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 17565 - pme_spread.cpp:188-199 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17566 - pme_spread.cpp:197-199 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17568 - pme_spread.cpp:199-199 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17567 - pme_spread.cpp:197-199 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 17561 - pme_spread.cpp:188-199 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17562 - pme_spread.cpp:197-199 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17563 - pme_spread.cpp:197-199 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17564 - pme_spread.cpp:197-199 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 17554 - pme_spread.cpp:277-975 - libgromacs_mpi.so.9.0.0 [...] | 0.46 | 0.46 | 0.31 | 0.31 | 0.07 | 0.07 | 64 | 0.24 | 0.04 | |||
| ►Loop 17555 - pme_spread.cpp:292-292 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 17559 - pme_spread.cpp:292-292 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17560 - pme_spread.cpp:292-292 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17558 - pme_spread.cpp:292-292 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17556 - pme_spread.cpp:292-292 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17557 - pme_spread.cpp:292-292 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○exp | libm.so.6 | 0.93 | 0.93 | 0.24 | 0.24 | 0.14 | 0.14 | 192 | 0.28 | 0.04 | Math (%): 100.00 | |
| ►.omp_outlined..9#0x65dd70 | libgromacs_mpi.so.9.0.0 | 0.91 | 0.00 | 0.28 | 0.01 | 0.14 | 0.00 | 128 | 0.16 | 0.02 | /home/eoseret/gromacs-2024.2/install_MPI/lib64/libgromacs_mpi.so.9.0.0 (%): 100.00 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 --driver-mode=g++ -D GMX_DOUBLE=0 -D HAVE_CONFIG_H -D TMPI_EXPORTS -D TMPI_USE_VISIBILITY -D USE_STD_INTTYPES_H -D libgromacs_EXPORTS -I /home/eoseret/g... |
| ○Loop 1699 - pairlist.cpp:3639-3639 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 1743 - pairlist.cpp:162-4126 - libgromacs_mpi.so.9.0.0 [...] | 0.91 | 0.00 | 0.68 | 0.00 | 0.14 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 1742 - pairlist.cpp:162-4126 - libgromacs_mpi.so.9.0.0 [...] | 0.91 | 0.00 | 0.68 | 0.00 | 0.14 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 1741 - pairlist.cpp:162-4126 - libgromacs_mpi.so.9.0.0 [...] | 0.91 | 0.00 | 0.68 | 0.00 | 0.14 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 1740 - pairlist.cpp:162-4126 - libgromacs_mpi.so.9.0.0 [...] | 0.91 | 0.00 | 0.68 | 0.00 | 0.14 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 1739 - pairlist.cpp:162-4126 - libgromacs_mpi.so.9.0.0 [...] | 0.91 | 0.00 | 0.68 | 0.00 | 0.14 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 1738 - pairlist.cpp:162-4126 - libgromacs_mpi.so.9.0.0 [...] | 0.91 | 0.00 | 0.68 | 0.00 | 0.14 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 1737 - pairlist.cpp:162-4126 - libgromacs_mpi.so.9.0.0 [...] | 0.91 | 0.04 | 0.68 | 0.03 | 0.14 | 0.01 | 97 | 0.04 | 0.01 | |||
| ○Loop 1749 - pairlist.cpp:1279-1282 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.01 | 0.01 | 0.00 | 0.00 | 10 | 0.01 | 0.00 | |||
| ○Loop 1779 - stl_algobase.h:911-912 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.01 | 0.01 | 0.00 | 0.00 | 8 | 0.00 | 0.00 | |||
| ○Loop 1765 - stl_uninitialized.h:318-318 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 1776 - pairlist.cpp:2092-2096 - libgromacs_mpi.so.9.0.0 [...] | 0.01 | 0.01 | 0.01 | 0.01 | 0.00 | 0.00 | 30 | 0.01 | 0.00 | |||
| ►Loop 1744 - pairlist.cpp:1330-1430 - libgromacs_mpi.so.9.0.0 [...] | 0.07 | 0.02 | 0.09 | 0.02 | 0.01 | 0.00 | 67 | 0.02 | 0.00 | |||
| ►Loop 1745 - pairlist.cpp:1330-1430 - libgromacs_mpi.so.9.0.0 [...] | 0.02 | 0.02 | 0.04 | 0.03 | 0.00 | 0.00 | 82 | 0.03 | 0.01 | |||
| ○Loop 1746 - pairlist.cpp:1341-1347 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 13 | 0.00 | 0.00 | |||
| ►Loop 1747 - pairlist.cpp:1330-1430 - libgromacs_mpi.so.9.0.0 [...] | 0.02 | 0.02 | 0.04 | 0.03 | 0.00 | 0.00 | 77 | 0.03 | 0.00 | |||
| ○Loop 1748 - pairlist.cpp:1341-1347 - libgromacs_mpi.so.9.0.0 [...] | 0.01 | 0.01 | 0.01 | 0.01 | 0.00 | 0.00 | 29 | 0.01 | 0.00 | |||
| ○Loop 1773 - pairlist.cpp:2099-2101 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.01 | 0.01 | 0.00 | 0.00 | 9 | 0.00 | 0.00 | |||
| ○Loop 1774 - pairlist.cpp:2099-2101 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.01 | 0.01 | 0.00 | 0.00 | 3 | 0.00 | 0.00 | |||
| ►Loop 1750 - pairlist.cpp:162-4104 - libgromacs_mpi.so.9.0.0 [...] | 0.71 | 0.03 | 0.37 | 0.03 | 0.11 | 0.00 | 103 | 0.03 | 0.00 | |||
| ►Loop 1751 - pairlist.cpp:162-4104 - libgromacs_mpi.so.9.0.0 [...] | 0.67 | 0.25 | 0.35 | 0.09 | 0.10 | 0.04 | 128 | 0.11 | 0.02 | |||
| ○Loop 1764 - pairlist.cpp:3503-3505 - libgromacs_mpi.so.9.0.0 [...] | 0.12 | 0.12 | 0.06 | 0.06 | 0.02 | 0.02 | 125 | 0.08 | 0.01 | |||
| ○Loop 1752 - pairlist.cpp:3113-3113 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 1753 - vector.tcc:477-504 - libgromacs_mpi.so.9.0.0 [...] | 0.02 | 0.02 | 0.03 | 0.02 | 0.00 | 0.00 | 87 | 0.02 | 0.00 | |||
| ○Loop 1754 - stl_uninitialized.h:318-318 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 1755 - new_allocator.h:162-162 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 1 | 0.00 | 0.00 | |||
| ○Loop 1762 - pairlist.cpp:376-1046 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 1763 - pairlist.cpp:3518-3520 - libgromacs_mpi.so.9.0.0 [...] | 0.05 | 0.05 | 0.05 | 0.05 | 0.01 | 0.01 | 95 | 0.07 | 0.01 | |||
| ►Loop 1758 - vector.tcc:477-504 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 1760 - new_allocator.h:162-162 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 1759 - stl_uninitialized.h:318-318 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 1757 - pairlist_simd_2xmm.h:130-174 - libgromacs_mpi.so.9.0.0 [...] | 0.16 | 0.16 | 0.07 | 0.07 | 0.02 | 0.02 | 128 | 0.09 | 0.01 | |||
| ○Loop 1756 - pairlist_simd_2xmm.h:185-229 - libgromacs_mpi.so.9.0.0 [...] | 0.08 | 0.08 | 0.04 | 0.04 | 0.01 | 0.01 | 125 | 0.06 | 0.01 | |||
| ○Loop 1761 - pairlist.cpp:376-1091 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 1778 - pairlist.cpp:2082-2086 - libgromacs_mpi.so.9.0.0 [...] | 0.01 | 0.01 | 0.01 | 0.01 | 0.00 | 0.00 | 33 | 0.02 | 0.00 | |||
| ○Loop 1777 - pairlist.cpp:2082-2086 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 9 | 0.00 | 0.00 | |||
| ○Loop 1775 - pairlist.cpp:2092-2096 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 1780 - stl_algobase.h:911-912 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 1736 - pairlist.cpp:233-4126 - libgromacs_mpi.so.9.0.0 [...] | 0.08 | 0.01 | 0.12 | 0.01 | 0.01 | 0.00 | 57 | 0.02 | 0.00 | |||
| ○Loop 1767 - pairlist.cpp:282-286 - libgromacs_mpi.so.9.0.0 [...] | 0.01 | 0.01 | 0.01 | 0.01 | 0.00 | 0.00 | 33 | 0.02 | 0.00 | |||
| ○Loop 1766 - pairlist.cpp:291-293 - libgromacs_mpi.so.9.0.0 [...] | 0.01 | 0.01 | 0.01 | 0.01 | 0.00 | 0.00 | 39 | 0.02 | 0.00 | |||
| ►Loop 1735 - pairlist.cpp:233-4126 - libgromacs_mpi.so.9.0.0 [...] | 0.06 | 0.02 | 0.08 | 0.01 | 0.01 | 0.00 | 69 | 0.02 | 0.00 | |||
| ►Loop 1770 - pairlist.cpp:233-4126 - libgromacs_mpi.so.9.0.0 [...] | 0.02 | 0.01 | 0.04 | 0.01 | 0.00 | 0.00 | 37 | 0.01 | 0.00 | |||
| ►Loop 1732 - pairlist.cpp:233-4126 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.01 | 0.00 | 0.00 | 0.00 | 9 | 0.00 | 0.00 | |||
| ○Loop 1733 - pairlist.cpp:2996-2996 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 1695 - pairlist.cpp:233-4126 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 1 | 0.00 | 0.00 | |||
| ►Loop 1696 - pairlist.cpp:254-4126 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 1731 - pairlist.cpp:2883-2886 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 1697 - pairlist.cpp:254-4126 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 1698 - pairlist.cpp:254-4126 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 1730 - pairlist.cpp:282-286 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 1702 - pairlist.cpp:254-4126 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 1705 - pairlist.cpp:894-1937 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 1706 - pairlist.cpp:894-1937 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 1707 - pairlist.cpp:894-1919 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 1708 - grid.h:239-295 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 1709 - pairlist.cpp:894-1919 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 1710 - stl_uninitialized.h:1031-1031 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 1728 - pairlist.cpp:282-286 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 1715 - pairlist.cpp:1279-1282 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 1716 - pairlist.cpp:405-3561 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 1717 - pairlist.cpp:405-3561 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 1718 - pairlist.cpp:405-3065 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 1719 - stl_vector.h:353-1798 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 1723 - impl_x86_avx_512_simd4_float.h:55-261 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 1721 - stl_uninitialized.h:1031-1031 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 1720 - stl_uninitialized.h:1031-1031 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 1722 - stl_uninitialized.h:1031-1031 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 1724 - pairlist.cpp:3518-3520 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 1725 - pairlist.cpp:3503-3505 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 1703 - stl_vector.h:346-1762 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 1704 - stl_uninitialized.h:1031-1031 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 1701 - pairlist.cpp:2448-2459 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 1726 - stl_uninitialized.h:1031-1031 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 1727 - pairlist.cpp:291-293 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 1711 - pairlist.cpp:894-2039 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 1712 - pairlist.cpp:894-2039 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 1714 - pairlist.cpp:1341-1347 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 1713 - stl_uninitialized.h:1031-1031 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 1700 - pairlist.cpp:2333-2342 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 1729 - pairlist.cpp:291-293 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 1734 - pairlist.cpp:2996-2996 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 1771 - pairlist.cpp:2868-3308 - libgromacs_mpi.so.9.0.0 [...] | 0.01 | 0.01 | 0.02 | 0.01 | 0.00 | 0.00 | 40 | 0.02 | 0.00 | |||
| ○Loop 1772 - pairlist.cpp:2883-2886 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 11 | 0.00 | 0.00 | |||
| ○Loop 1769 - pairlist.cpp:282-286 - libgromacs_mpi.so.9.0.0 [...] | 0.01 | 0.01 | 0.01 | 0.01 | 0.00 | 0.00 | 35 | 0.01 | 0.00 | |||
| ○Loop 1768 - pairlist.cpp:291-293 - libgromacs_mpi.so.9.0.0 [...] | 0.01 | 0.01 | 0.01 | 0.01 | 0.00 | 0.00 | 53 | 0.02 | 0.00 | |||
| ○impi_shm_heap_progress | libmpi.so.12.0.0 | 0.86 | 0.86 | 0.37 | 0.37 | 0.13 | 0.13 | 192 | 0.46 | 0.07 | MPI (%): 100.00 | |
| ○MPIDI_SHMI_progress | libmpi.so.12.0.0 | 0.56 | 0.56 | 0.23 | 0.23 | 0.09 | 0.09 | 192 | 0.30 | 0.05 | MPI (%): 100.00 | |
| ►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 | 0.53 | 0.00 | 0.39 | 0.01 | 0.08 | 0.00 | 117 | 0.58 | 0.09 | /home/eoseret/gromacs-2024.2/install_MPI/lib64/libgromacs_mpi.so.9.0.0 (%): 100.00 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 --driver-mode=g++ -D GMX_DOUBLE=0 -D HAVE_CONFIG_H -D TMPI_EXPORTS -D TMPI_USE_VISIBILITY -D USE_STD_INTTYPES_H -D libgromacs_EXPORTS -I /home/eoseret/g... |
| ►Loop 14947 - lincs.cpp:278-295 - libgromacs_mpi.so.9.0.0 [...] | 0.53 | 0.00 | 0.40 | 0.00 | 0.08 | 0.00 | 7 | 0.00 | 0.00 | |||
| ►Loop 14948 - lincs.cpp:284-295 - libgromacs_mpi.so.9.0.0 [...] | 0.53 | 0.26 | 0.39 | 0.19 | 0.08 | 0.04 | 113 | 0.29 | 0.05 | |||
| ○Loop 14949 - lincs.cpp:290-292 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 14950 - lincs.cpp:290-292 - libgromacs_mpi.so.9.0.0 | 0.27 | 0.27 | 0.20 | 0.20 | 0.04 | 0.04 | 112 | 0.31 | 0.05 | |||
| ►Loop 14943 - lincs.cpp:328-348 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 14944 - lincs.cpp:328-348 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 14946 - lincs.cpp:340-344 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 14945 - lincs.cpp:340-344 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 14941 - lincs.cpp:328-328 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 14942 - lincs.cpp:328-328 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►.omp_outlined..37 | libgromacs_mpi.so.9.0.0 | 0.48 | 0.01 | 0.32 | 0.01 | 0.08 | 0.00 | 118 | 0.53 | 0.08 | /home/eoseret/gromacs-2024.2/install_MPI/lib64/libgromacs_mpi.so.9.0.0 (%): 100.00 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 --driver-mode=g++ -D GMX_DOUBLE=0 -D HAVE_CONFIG_H -D TMPI_EXPORTS -D TMPI_USE_VISIBILITY -D USE_STD_INTTYPES_H -D libgromacs_EXPORTS -I /home/eoseret/g... |
| ○Loop 14923 - lincs.cpp:1146-1148 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.01 | 0.01 | 0.00 | 0.00 | 23 | 0.01 | 0.00 | |||
| ○Loop 14918 - lincs.cpp:1245-1245 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.01 | 0.01 | 0.00 | 0.00 | 3 | 0.00 | 0.00 | |||
| ○Loop 14915 - lincs.cpp:1252-1257 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 14920 - lincs.cpp:845-1223 - libgromacs_mpi.so.9.0.0 [...] | 0.13 | 0.00 | 0.10 | 0.01 | 0.02 | 0.00 | 13 | 0.01 | 0.00 | |||
| ○Loop 14921 - lincs.cpp:966-992 - libgromacs_mpi.so.9.0.0 [...] | 0.13 | 0.13 | 0.08 | 0.08 | 0.02 | 0.02 | 107 | 0.14 | 0.02 | |||
| ○Loop 14922 - lincs.cpp:1205-1207 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.01 | 0.01 | 0.00 | 0.00 | 18 | 0.01 | 0.00 | |||
| ○Loop 14914 - lincs.cpp:1265-1273 - libgromacs_mpi.so.9.0.0 | 0.01 | 0.01 | 0.01 | 0.01 | 0.00 | 0.00 | 42 | 0.02 | 0.00 | |||
| ►Loop 14924 - lincs.cpp:1133-1137 - libgromacs_mpi.so.9.0.0 [...] | 0.09 | 0.03 | 0.09 | 0.04 | 0.01 | 0.01 | 74 | 0.06 | 0.01 | |||
| ○Loop 14925 - lincs.cpp:1135-1137 - libgromacs_mpi.so.9.0.0 [...] | 0.06 | 0.06 | 0.05 | 0.05 | 0.01 | 0.01 | 93 | 0.08 | 0.01 | |||
| ○Loop 14919 - lincs.cpp:1245-1245 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 14916 - lincs.cpp:1252-1257 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 14926 - lincs.cpp:845-857 - libgromacs_mpi.so.9.0.0 [...] | 0.24 | 0.24 | 0.18 | 0.18 | 0.04 | 0.04 | 112 | 0.28 | 0.04 | |||
| ○Loop 14917 - lincs.cpp:1243-1245 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○I_MPI_memcpy_multipage_sse | libmpi.so.12.0.0 | 0.43 | 0.00 | 0.26 | 0.00 | 0.07 | 0.00 | 128 | 0.53 | 0.08 | MPI (%): 100.00 | |
| ►void nbnxmSimdPruneKernel<(KernelLayout)1>(NbnxnPairlistCpu*, nbnxn_atomdata_t const&, gmx::ArrayRef<gmx::BasicVector<float> const>, float) | libgromacs_mpi.so.9.0.0 | 0.37 | 0.00 | 0.14 | 0.00 | 0.06 | 0.00 | 128 | 0.12 | 0.02 | /home/eoseret/gromacs-2024.2/install_MPI/lib64/libgromacs_mpi.so.9.0.0 (%): 100.00 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 --driver-mode=g++ -D GMX_DOUBLE=0 -D HAVE_CONFIG_H -D TMPI_EXPORTS -D TMPI_USE_VISIBILITY -D USE_STD_INTTYPES_H -D libgromacs_EXPORTS -I /home/eoseret/g... |
| ►Loop 2671 - simd_prune_kernel.cpp:106-213 - libgromacs_mpi.so.9.0.0 [...] | 0.37 | 0.02 | 0.15 | 0.02 | 0.06 | 0.00 | 87 | 0.02 | 0.00 | |||
| ○Loop 2672 - simd_prune_kernel.cpp:144-204 - libgromacs_mpi.so.9.0.0 [...] | 0.35 | 0.35 | 0.14 | 0.14 | 0.05 | 0.05 | 128 | 0.12 | 0.02 | |||
| ►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 | 0.33 | 0.00 | 0.29 | 0.01 | 0.05 | 0.00 | 108 | 0.46 | 0.07 | /home/eoseret/gromacs-2024.2/install_MPI/lib64/libgromacs_mpi.so.9.0.0 (%): 100.00 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 --driver-mode=g++ -D GMX_DOUBLE=0 -D HAVE_CONFIG_H -D TMPI_EXPORTS -D TMPI_USE_VISIBILITY -D USE_STD_INTTYPES_H -D libgromacs_EXPORTS -I /home/eoseret/g... |
| ►Loop 16801 - bonded.cpp:2066-2126 - libgromacs_mpi.so.9.0.0 [...] | 0.33 | 0.28 | 0.30 | 0.23 | 0.05 | 0.04 | 106 | 0.39 | 0.06 | |||
| ○Loop 16802 - bonded.cpp:2072-2087 - libgromacs_mpi.so.9.0.0 | 0.05 | 0.05 | 0.07 | 0.07 | 0.01 | 0.01 | 81 | 0.09 | 0.01 | |||
| ►solve_pme_yzx(gmx_pme_t const*, t_complex*, float, bool, int, int) | libgromacs_mpi.so.9.0.0 | 0.31 | 0.00 | 0.21 | 0.01 | 0.05 | 0.00 | 64 | 0.16 | 0.03 | /home/eoseret/gromacs-2024.2/install_MPI/lib64/libgromacs_mpi.so.9.0.0 (%): 100.00 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 --driver-mode=g++ -D GMX_DOUBLE=0 -D HAVE_CONFIG_H -D TMPI_EXPORTS -D TMPI_USE_VISIBILITY -D USE_STD_INTTYPES_H -D libgromacs_EXPORTS -I /home/eoseret/g... |
| ►Loop 17436 - pme_solve.cpp:233-560 - libgromacs_mpi.so.9.0.0 [...] | 0.31 | 0.03 | 0.34 | 0.04 | 0.05 | 0.00 | 60 | 0.05 | 0.01 | |||
| ○Loop 17447 - pme_solve.cpp:487-495 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.01 | 0.01 | 0.00 | 0.00 | 18 | 0.01 | 0.00 | |||
| ○Loop 17437 - pme_solve.cpp:556-560 - libgromacs_mpi.so.9.0.0 | 0.02 | 0.02 | 0.02 | 0.02 | 0.00 | 0.00 | 50 | 0.04 | 0.01 | |||
| ○Loop 17455 - pme_solve.cpp:440-453 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17439 - pme_solve.cpp:556-560 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17456 - pme_solve.cpp:442-453 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.01 | 0.01 | 0.00 | 0.00 | 11 | 0.01 | 0.00 | |||
| ○Loop 17443 - pme_solve.cpp:521-530 - libgromacs_mpi.so.9.0.0 | 0.05 | 0.05 | 0.05 | 0.05 | 0.01 | 0.01 | 63 | 0.07 | 0.01 | |||
| ○Loop 17440 - pme_solve.cpp:233-233 - libgromacs_mpi.so.9.0.0 [...] | 0.06 | 0.06 | 0.05 | 0.05 | 0.01 | 0.01 | 64 | 0.08 | 0.01 | |||
| ○Loop 17441 - pme_solve.cpp:533-542 - libgromacs_mpi.so.9.0.0 | 0.06 | 0.06 | 0.05 | 0.05 | 0.01 | 0.01 | 63 | 0.07 | 0.01 | |||
| ○Loop 17445 - pme_solve.cpp:485-495 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17452 - pme_solve.cpp:474-474 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17453 - pme_solve.cpp:456-469 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17438 - pme_solve.cpp:554-560 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17449 - pme_solve.cpp:233-233 - libgromacs_mpi.so.9.0.0 [...] | 0.01 | 0.01 | 0.01 | 0.01 | 0.00 | 0.00 | 29 | 0.02 | 0.00 | |||
| ○Loop 17444 - pme_solve.cpp:523-530 - libgromacs_mpi.so.9.0.0 | 0.01 | 0.01 | 0.02 | 0.02 | 0.00 | 0.00 | 48 | 0.02 | 0.00 | |||
| ○Loop 17454 - pme_solve.cpp:458-469 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 4 | 0.00 | 0.00 | |||
| ○Loop 17450 - pme_solve.cpp:474-474 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.01 | 0.01 | 0.00 | 0.00 | 12 | 0.01 | 0.00 | |||
| ○Loop 17448 - pme_solve.cpp:487-495 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17446 - pme_solve.cpp:498-510 - libgromacs_mpi.so.9.0.0 | 0.05 | 0.05 | 0.05 | 0.05 | 0.01 | 0.01 | 64 | 0.07 | 0.01 | |||
| ○Loop 17451 - pme_solve.cpp:472-474 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17442 - pme_solve.cpp:535-542 - libgromacs_mpi.so.9.0.0 | 0.01 | 0.01 | 0.01 | 0.01 | 0.00 | 0.00 | 36 | 0.02 | 0.00 | |||
| ►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 | 0.30 | 0.00 | 0.13 | 0.01 | 0.05 | 0.00 | 128 | 0.19 | 0.03 | /home/eoseret/gromacs-2024.2/install_MPI/lib64/libgromacs_mpi.so.9.0.0 (%): 100.00 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 --driver-mode=g++ -D GMX_DOUBLE=0 -D HAVE_CONFIG_H -D TMPI_EXPORTS -D TMPI_USE_VISIBILITY -D USE_STD_INTTYPES_H -D libgromacs_EXPORTS -I /home/eoseret/g... |
| ○Loop 15263 - settle.cpp:425-425 - libgromacs_mpi.so.9.0.0 [...] | 0.26 | 0.26 | 0.12 | 0.12 | 0.04 | 0.04 | 127 | 0.17 | 0.03 | |||
| ○Loop 15261 - settle.cpp:425-425 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 15264 - settle.cpp:425-657 - libgromacs_mpi.so.9.0.0 [...] | 0.03 | 0.03 | 0.03 | 0.03 | 0.01 | 0.01 | 94 | 0.04 | 0.01 | |||
| ○Loop 15262 - settle.cpp:425-657 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 15258 - functions.h:164-164 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 15259 - functions.h:164-164 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 15260 - functions.h:164-164 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 15257 - functions.h:164-164 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○MPID_Progress_completion_count_get | libmpi.so.12.0.0 | 0.27 | 0.27 | 0.12 | 0.12 | 0.04 | 0.04 | 192 | 0.16 | 0.02 | MPI (%): 100.00 | |
| ►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 | 0.26 | 0.00 | 0.23 | 0.01 | 0.04 | 0.00 | 106 | 0.36 | 0.06 | /home/eoseret/gromacs-2024.2/install_MPI/lib64/libgromacs_mpi.so.9.0.0 (%): 100.00 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 --driver-mode=g++ -D GMX_DOUBLE=0 -D HAVE_CONFIG_H -D TMPI_EXPORTS -D TMPI_USE_VISIBILITY -D USE_STD_INTTYPES_H -D libgromacs_EXPORTS -I /home/eoseret/g... |
| ○Loop 17094 - pairs.cpp:125-828 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 17097 - pairs.cpp:873-911 - libgromacs_mpi.so.9.0.0 [...] | 0.20 | 0.16 | 0.18 | 0.14 | 0.03 | 0.02 | 104 | 0.23 | 0.04 | |||
| ○Loop 17098 - pairs.cpp:879-904 - libgromacs_mpi.so.9.0.0 [...] | 0.04 | 0.04 | 0.04 | 0.04 | 0.01 | 0.01 | 79 | 0.06 | 0.01 | |||
| ○Loop 17096 - pairs.cpp:873-938 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17095 - vec.h:141-345 - libgromacs_mpi.so.9.0.0 [...] | 0.06 | 0.06 | 0.06 | 0.06 | 0.01 | 0.01 | 87 | 0.09 | 0.01 | |||
| ○mkl_dft_def_ownscDftFwd_Prime8_32fc | libmkl_def.so.2 | 0.25 | 0.25 | 0.20 | 0.20 | 0.04 | 0.04 | 64 | 0.16 | 0.02 | Math (%): 100.00 | |
| ►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 | 0.25 | 0.00 | 0.23 | 0.02 | 0.04 | 0.00 | 107 | 0.30 | 0.05 | /home/eoseret/gromacs-2024.2/install_MPI/lib64/libgromacs_mpi.so.9.0.0 (%): 100.00 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 --driver-mode=g++ -D GMX_DOUBLE=0 -D HAVE_CONFIG_H -D TMPI_EXPORTS -D TMPI_USE_VISIBILITY -D USE_STD_INTTYPES_H -D libgromacs_EXPORTS -I /home/eoseret/g... |
| ►Loop 16790 - bonded.cpp:1151-1185 - libgromacs_mpi.so.9.0.0 [...] | 0.25 | 0.22 | 0.25 | 0.21 | 0.04 | 0.03 | 105 | 0.27 | 0.04 | |||
| ○Loop 16791 - bonded.cpp:1157-1178 - libgromacs_mpi.so.9.0.0 [...] | 0.02 | 0.02 | 0.05 | 0.05 | 0.00 | 0.00 | 69 | 0.05 | 0.01 | |||
| ►copy_rvec_to_nbat_real(int const*, int, int, float const (*) [3], int, float*, int) | libgromacs_mpi.so.9.0.0 | 0.25 | 0.00 | 0.10 | 0.00 | 0.04 | 0.00 | 128 | 0.11 | 0.02 | /home/eoseret/gromacs-2024.2/install_MPI/lib64/libgromacs_mpi.so.9.0.0 (%): 100.00 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 --driver-mode=g++ -D GMX_DOUBLE=0 -D HAVE_CONFIG_H -D TMPI_EXPORTS -D TMPI_USE_VISIBILITY -D USE_STD_INTTYPES_H -D libgromacs_EXPORTS -I /home/eoseret/g... |
| ○Loop 1319 - atomdata.cpp:180-184 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 1325 - atomdata.cpp:193-200 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 1323 - atomdata.cpp:226-233 - libgromacs_mpi.so.9.0.0 | 0.21 | 0.21 | 0.09 | 0.09 | 0.03 | 0.03 | 128 | 0.11 | 0.02 | |||
| ○Loop 1328 - atomdata.cpp:165-165 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 1324 - atomdata.cpp:207-214 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 1322 - atomdata.cpp:240-247 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 1 | 0.00 | 0.00 | |||
| ○Loop 1320 - atomdata.cpp:180-185 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 1329 - atomdata.cpp:154-158 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 1326 - atomdata.cpp:165-165 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 1327 - atomdata.cpp:161-165 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 1321 - atomdata.cpp:172-177 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○mkl_dft_def_ownscDftInv_Prime8_32fc | libmkl_def.so.2 | 0.25 | 0.25 | 0.17 | 0.17 | 0.04 | 0.04 | 64 | 0.16 | 0.02 | Math (%): 100.00 | |
| ►.omp_outlined..28 | libgromacs_mpi.so.9.0.0 | 0.22 | 0.00 | 0.10 | 0.01 | 0.03 | 0.00 | 128 | 0.11 | 0.02 | /home/eoseret/gromacs-2024.2/install_MPI/lib64/libgromacs_mpi.so.9.0.0 (%): 100.00 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 --driver-mode=g++ -D GMX_DOUBLE=0 -D HAVE_CONFIG_H -D TMPI_EXPORTS -D TMPI_USE_VISIBILITY -D USE_STD_INTTYPES_H -D libgromacs_EXPORTS -I /home/eoseret/g... |
| ►Loop 1600 - atomdata.cpp:1113-1257 - libgromacs_mpi.so.9.0.0 [...] | 0.22 | 0.00 | 0.10 | 0.00 | 0.03 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 1603 - atomdata.cpp:1137-1143 - libgromacs_mpi.so.9.0.0 [...] | 0.22 | 0.22 | 0.10 | 0.10 | 0.03 | 0.03 | 128 | 0.11 | 0.02 | |||
| ○Loop 1602 - atomdata.cpp:1127-1133 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 1601 - atomdata.cpp:1117-1123 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►dd_move_f(gmx_domdec_t*, gmx::ForceWithShiftForces*, gmx_wallcycle*) | libgromacs_mpi.so.9.0.0 | 0.22 | 0.01 | 0.10 | 0.01 | 0.03 | 0.00 | 128 | 0.11 | 0.02 | /home/eoseret/gromacs-2024.2/install_MPI/lib64/libgromacs_mpi.so.9.0.0 (%): 100.00 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 --driver-mode=g++ -D GMX_DOUBLE=0 -D HAVE_CONFIG_H -D TMPI_EXPORTS -D TMPI_USE_VISIBILITY -D USE_STD_INTTYPES_H -D libgromacs_EXPORTS -I /home/eoseret/g... |
| ►Loop 2991 - domdec.cpp:367-453 - libgromacs_mpi.so.9.0.0 [...] | 0.22 | 0.00 | 0.14 | 0.01 | 0.03 | 0.00 | 20 | 0.00 | 0.00 | |||
| ►Loop 2992 - domdec.cpp:381-453 - libgromacs_mpi.so.9.0.0 [...] | 0.21 | 0.01 | 0.14 | 0.01 | 0.03 | 0.00 | 37 | 0.02 | 0.00 | |||
| ►Loop 2998 - domdec.cpp:401-405 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.01 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3000 - domdec.cpp:403-405 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 2 | 0.00 | 0.00 | |||
| ○Loop 2999 - domdec.cpp:403-405 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.01 | 0.01 | 0.00 | 0.00 | 2 | 0.00 | 0.00 | |||
| ○Loop 2995 - stl_iterator.h:1054-1182 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 2996 - domdec.cpp:442-453 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 2997 - domdec.cpp:403-405 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 2994 - domdec.cpp:426-435 - libgromacs_mpi.so.9.0.0 [...] | 0.01 | 0.01 | 0.02 | 0.02 | 0.00 | 0.00 | 26 | 0.03 | 0.00 | |||
| ○Loop 3001 - stl_uninitialized.h:1031-1031 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 2993 - domdec.cpp:415-419 - libgromacs_mpi.so.9.0.0 [...] | 0.20 | 0.20 | 0.09 | 0.09 | 0.03 | 0.03 | 128 | 0.10 | 0.02 | |||
| ○Loop 3002 - stl_uninitialized.h:1031-1031 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►.omp_outlined.#0xc0af60 | libgromacs_mpi.so.9.0.0 | 0.20 | 0.00 | 0.18 | 0.01 | 0.03 | 0.00 | 64 | 0.17 | 0.03 | /home/eoseret/gromacs-2024.2/install_MPI/lib64/libgromacs_mpi.so.9.0.0 (%): 100.00 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 --driver-mode=g++ -D GMX_DOUBLE=0 -D HAVE_CONFIG_H -D TMPI_EXPORTS -D TMPI_USE_VISIBILITY -D USE_STD_INTTYPES_H -D libgromacs_EXPORTS -I /home/eoseret/g... |
| ►Loop 1401 - pme_redistribute.cpp:81-138 - libgromacs_mpi.so.9.0.0 [...] | 0.20 | 0.00 | 0.23 | 0.00 | 0.03 | 0.00 | 6 | 0.00 | 0.00 | |||
| ○Loop 1403 - pme_redistribute.cpp:111-118 - libgromacs_mpi.so.9.0.0 | 0.10 | 0.10 | 0.13 | 0.13 | 0.02 | 0.02 | 64 | 0.12 | 0.02 | |||
| ○Loop 1402 - pme_redistribute.cpp:96-103 - libgromacs_mpi.so.9.0.0 | 0.10 | 0.10 | 0.10 | 0.10 | 0.02 | 0.02 | 64 | 0.11 | 0.02 | |||
| ►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 | 0.20 | 0.00 | 0.16 | 0.01 | 0.03 | 0.00 | 113 | 0.22 | 0.03 | /home/eoseret/gromacs-2024.2/install_MPI/lib64/libgromacs_mpi.so.9.0.0 (%): 100.00 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 --driver-mode=g++ -D GMX_DOUBLE=0 -D HAVE_CONFIG_H -D TMPI_EXPORTS -D TMPI_USE_VISIBILITY -D USE_STD_INTTYPES_H -D libgromacs_EXPORTS -I /home/eoseret/g... |
| ○Loop 14951 - lincs.cpp:396-409 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 14952 - lincs.cpp:376-391 - libgromacs_mpi.so.9.0.0 [...] | 0.20 | 0.20 | 0.16 | 0.16 | 0.03 | 0.03 | 111 | 0.21 | 0.03 | |||
| ○mkl_dft_def_owns_cRadix4FwdNorm_32fc | libmkl_def.so.2 | 0.19 | 0.19 | 0.14 | 0.14 | 0.03 | 0.03 | 64 | 0.15 | 0.02 | Math (%): 100.00 | |
| ►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 | 0.18 | 0.00 | 0.13 | 0.00 | 0.03 | 0.00 | 64 | 0.15 | 0.02 | /home/eoseret/gromacs-2024.2/install_MPI/lib64/libgromacs_mpi.so.9.0.0 (%): 100.00 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 --driver-mode=g++ -D GMX_DOUBLE=0 -D HAVE_CONFIG_H -D TMPI_EXPORTS -D TMPI_USE_VISIBILITY -D USE_STD_INTTYPES_H -D libgromacs_EXPORTS -I /home/eoseret/g... |
| ►Loop 17422 - pme_redistribute.cpp:126-501 - libgromacs_mpi.so.9.0.0 [...] | 0.18 | 0.00 | 0.15 | 0.00 | 0.03 | 0.00 | 10 | 0.00 | 0.00 | |||
| ○Loop 17427 - pme_redistribute.cpp:294-298 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 2 | 0.00 | 0.00 | |||
| ○Loop 17423 - pme_redistribute.cpp:265-398 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.01 | 0.01 | 0.00 | 0.00 | 21 | 0.01 | 0.00 | |||
| ○Loop 17424 - pme_redistribute.cpp:345-367 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17426 - pme_redistribute.cpp:252-338 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 7 | 0.00 | 0.00 | |||
| ○Loop 17428 - pme_redistribute.cpp:294-298 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17425 - pme_redistribute.cpp:345-367 - libgromacs_mpi.so.9.0.0 [...] | 0.17 | 0.17 | 0.12 | 0.12 | 0.03 | 0.03 | 64 | 0.14 | 0.02 | |||
| ►Loop 17429 - pme_redistribute.cpp:145-149 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17430 - pme_redistribute.cpp:147-149 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○MPIDIG_send_origin_cb | libmpi.so.12.0.0 | 0.17 | 0.17 | 0.06 | 0.06 | 0.03 | 0.03 | 189 | 0.09 | 0.01 | MPI (%): 100.00 | |
| ○mkl_dft_def_owns_cRadix4InvNorm_32fc | libmkl_def.so.2 | 0.17 | 0.17 | 0.12 | 0.12 | 0.03 | 0.03 | 64 | 0.11 | 0.02 | Math (%): 100.00 | |
| ○.plt.sec@start | libm.so.6 | 0.16 | 0.16 | 0.07 | 0.07 | 0.03 | 0.03 | 190 | 0.08 | 0.01 | Math (%): 100.00 | |
| ○I_MPI_memcpy_sse | libmpi.so.12.0.0 | 0.16 | 0.16 | 0.07 | 0.07 | 0.02 | 0.02 | 189 | 0.09 | 0.01 | MPI (%): 100.00 | |
| ►dd_pmeredist_f(gmx_pme_t*, PmeAtomComm*, gmx::ArrayRef<gmx::BasicVector<float> >, bool) | libgromacs_mpi.so.9.0.0 | 0.15 | 0.00 | 0.13 | 0.01 | 0.02 | 0.00 | 64 | 0.13 | 0.02 | /home/eoseret/gromacs-2024.2/install_MPI/lib64/libgromacs_mpi.so.9.0.0 (%): 100.00 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 --driver-mode=g++ -D GMX_DOUBLE=0 -D HAVE_CONFIG_H -D TMPI_EXPORTS -D TMPI_USE_VISIBILITY -D USE_STD_INTTYPES_H -D libgromacs_EXPORTS -I /home/eoseret/g... |
| ○Loop 17421 - pme_redistribute.cpp:265-430 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.01 | 0.01 | 0.00 | 0.00 | 13 | 0.01 | 0.00 | |||
| ○Loop 17420 - pme_redistribute.cpp:436-449 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17419 - pme_redistribute.cpp:455-468 - libgromacs_mpi.so.9.0.0 [...] | 0.15 | 0.15 | 0.13 | 0.13 | 0.02 | 0.02 | 64 | 0.13 | 0.02 | |||
| ○mkl_dft_def_ownscDftInv_Fact3_32fc | libmkl_def.so.2 | 0.14 | 0.14 | 0.10 | 0.10 | 0.02 | 0.02 | 64 | 0.12 | 0.02 | Math (%): 100.00 | |
| ►.omp_outlined.#0xc138b0 | libgromacs_mpi.so.9.0.0 | 0.14 | 0.00 | 0.12 | 0.01 | 0.02 | 0.00 | 64 | 0.12 | 0.02 | /home/eoseret/gromacs-2024.2/install_MPI/lib64/libgromacs_mpi.so.9.0.0 (%): 100.00 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 --driver-mode=g++ -D GMX_DOUBLE=0 -D HAVE_CONFIG_H -D TMPI_EXPORTS -D TMPI_USE_VISIBILITY -D USE_STD_INTTYPES_H -D libgromacs_EXPORTS -I /home/eoseret/g... |
| ►Loop 1387 - pme_spread.cpp:75-923 - libgromacs_mpi.so.9.0.0 [...] | 0.14 | 0.00 | 0.12 | 0.00 | 0.02 | 0.00 | 3 | 0.00 | 0.00 | |||
| ○Loop 1388 - pme_spread.cpp:172-174 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 1394 - pme_spread.cpp:104-133 - libgromacs_mpi.so.9.0.0 [...] | 0.14 | 0.14 | 0.12 | 0.12 | 0.02 | 0.02 | 64 | 0.12 | 0.02 | |||
| ○Loop 1389 - pme_spread.cpp:172-174 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 1395 - pme_spread.cpp:104-145 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 1393 - pme_spread.cpp:154-156 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 1391 - pme_spread.cpp:167-167 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 1392 - pme_spread.cpp:167-167 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 1390 - pme_spread.cpp:165-167 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 1396 - pme_spread.cpp:96-98 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○mkl_dft_def_ownscDftFwd_Fact3_32fc | libmkl_def.so.2 | 0.14 | 0.14 | 0.09 | 0.09 | 0.02 | 0.02 | 64 | 0.11 | 0.02 | Math (%): 100.00 | |
| ○unknown_function | libgromacs_mpi.so.9.0.0 | 0.13 | 0.00 | 0.04 | 0.00 | 0.02 | 0.00 | 186 | 0.07 | 0.01 | /home/eoseret/gromacs-2024.2/install_MPI/lib64/libgromacs_mpi.so.9.0.0 (%): 100.00 | |
| ►dd_move_x(gmx_domdec_t*, float const (*) [3], gmx::ArrayRef<gmx::BasicVector<float> >, gmx_wallcycle*) | libgromacs_mpi.so.9.0.0 | 0.12 | 0.00 | 0.08 | 0.01 | 0.02 | 0.00 | 128 | 0.09 | 0.01 | /home/eoseret/gromacs-2024.2/install_MPI/lib64/libgromacs_mpi.so.9.0.0 (%): 100.00 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 --driver-mode=g++ -D GMX_DOUBLE=0 -D HAVE_CONFIG_H -D TMPI_EXPORTS -D TMPI_USE_VISIBILITY -D USE_STD_INTTYPES_H -D libgromacs_EXPORTS -I /home/eoseret/g... |
| ►Loop 2980 - domdec.cpp:273-351 - libgromacs_mpi.so.9.0.0 [...] | 0.12 | 0.00 | 0.13 | 0.00 | 0.02 | 0.00 | 2 | 0.00 | 0.00 | |||
| ►Loop 2981 - domdec.cpp:275-345 - libgromacs_mpi.so.9.0.0 [...] | 0.12 | 0.01 | 0.13 | 0.01 | 0.02 | 0.00 | 38 | 0.02 | 0.00 | |||
| ○Loop 2986 - stl_uninitialized.h:1031-1031 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 2987 - domdec.cpp:297-302 - libgromacs_mpi.so.9.0.0 [...] | 0.03 | 0.03 | 0.04 | 0.04 | 0.00 | 0.00 | 61 | 0.06 | 0.01 | |||
| ○Loop 2990 - stl_uninitialized.h:1031-1031 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 2982 - domdec.cpp:343-345 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 2983 - domdec.cpp:341-345 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.02 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 2984 - domdec.cpp:343-345 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.01 | 0.01 | 0.00 | 0.00 | 3 | 0.03 | 0.00 | |||
| ○Loop 2985 - domdec.cpp:343-345 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 2 | 0.00 | 0.00 | |||
| ○Loop 2988 - domdec.cpp:309-318 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 2989 - domdec.cpp:289-291 - libgromacs_mpi.so.9.0.0 [...] | 0.08 | 0.08 | 0.05 | 0.05 | 0.01 | 0.01 | 122 | 0.06 | 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 | 0.12 | 0.01 | 0.10 | 0.02 | 0.02 | 0.00 | 113 | 0.15 | 0.02 | /home/eoseret/gromacs-2024.2/install_MPI/lib64/libgromacs_mpi.so.9.0.0 (%): 100.00 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 --driver-mode=g++ -D GMX_DOUBLE=0 -D HAVE_CONFIG_H -D TMPI_EXPORTS -D TMPI_USE_VISIBILITY -D USE_STD_INTTYPES_H -D libgromacs_EXPORTS -I /home/eoseret/g... |
| ►Loop 3351 - localtopology.cpp:323-577 - libgromacs_mpi.so.9.0.0 [...] | 0.11 | 0.05 | 0.12 | 0.05 | 0.02 | 0.01 | 87 | 0.08 | 0.01 | |||
| ►Loop 3353 - localtopology.cpp:506-531 - libgromacs_mpi.so.9.0.0 [...] | 0.05 | 0.05 | 0.05 | 0.04 | 0.01 | 0.01 | 86 | 0.07 | 0.01 | |||
| ○Loop 3354 - hashedmap.h:277-282 - libgromacs_mpi.so.9.0.0 [...] | 0.01 | 0.01 | 0.01 | 0.01 | 0.00 | 0.00 | 26 | 0.01 | 0.00 | |||
| ○Loop 3355 - localtopology.cpp:506-531 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3352 - hashedmap.h:277-282 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.01 | 0.01 | 0.00 | 0.00 | 16 | 0.02 | 0.00 | |||
| ○_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 | 0.12 | 0.12 | 0.10 | 0.10 | 0.02 | 0.02 | 102 | 0.17 | 0.03 | /home/eoseret/gromacs-2024.2/install_MPI/lib64/libgromacs_mpi.so.9.0.0 (%): 100.00 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 --driver-mode=g++ -D GMX_DOUBLE=0 -D HAVE_CONFIG_H -D TMPI_EXPORTS -D TMPI_USE_VISIBILITY -D USE_STD_INTTYPES_H -D libgromacs_EXPORTS -I /home/eoseret/g... |
| ○__memset_avx512_unaligned_erms | libc.so.6 | 0.12 | 0.12 | 0.04 | 0.04 | 0.02 | 0.02 | 190 | 0.06 | 0.01 | Memory (%): 100.00 | |
| ○mkl_dft_def_ownscDftFwd_Fact4_32fc | libmkl_def.so.2 | 0.09 | 0.09 | 0.09 | 0.09 | 0.01 | 0.01 | 64 | 0.08 | 0.01 | Math (%): 100.00 | |
| ○mkl_dft_def_ownscDftInv_Fact4_32fc | libmkl_def.so.2 | 0.09 | 0.09 | 0.08 | 0.08 | 0.01 | 0.01 | 64 | 0.09 | 0.01 | Math (%): 100.00 | |
| ○mkl_dft_def_owns_cCcsRecombine_32f | libmkl_def.so.2 | 0.09 | 0.09 | 0.08 | 0.08 | 0.01 | 0.01 | 64 | 0.09 | 0.01 | Math (%): 100.00 | |
| ○mkl_dft_def_owns_cRealRecombine_32f | libmkl_def.so.2 | 0.09 | 0.09 | 0.07 | 0.07 | 0.01 | 0.01 | 64 | 0.08 | 0.01 | Math (%): 100.00 | |
| ○MPIDIG_send_target_msg_cb | libmpi.so.12.0.0 | 0.08 | 0.08 | 0.05 | 0.05 | 0.01 | 0.01 | 156 | 0.07 | 0.01 | MPI (%): 100.00 | |
| ►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 | 0.07 | 0.00 | 0.04 | 0.01 | 0.01 | 0.00 | 119 | 0.07 | 0.01 | /home/eoseret/gromacs-2024.2/install_MPI/lib64/libgromacs_mpi.so.9.0.0 (%): 100.00 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 --driver-mode=g++ -D GMX_DOUBLE=0 -D HAVE_CONFIG_H -D TMPI_EXPORTS -D TMPI_USE_VISIBILITY -D USE_STD_INTTYPES_H -D libgromacs_EXPORTS -I /home/eoseret/g... |
| ►Loop 3206 - domdec_specatomcomm.cpp:189-358 - libgromacs_mpi.so.9.0.0 [...] | 0.07 | 0.01 | 0.15 | 0.01 | 0.01 | 0.00 | 31 | 0.01 | 0.00 | |||
| ○Loop 3220 - domdec_specatomcomm.cpp:285-287 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3224 - domdec_specatomcomm.cpp:285-287 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.01 | 0.01 | 0.00 | 0.00 | 14 | 0.01 | 0.00 | |||
| ○Loop 3221 - domdec_specatomcomm.cpp:285-287 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3228 - domdec_specatomcomm.cpp:285-287 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 14 | 0.00 | 0.00 | |||
| ○Loop 3230 - domdec_specatomcomm.cpp:285-288 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 3231 - domdec_specatomcomm.cpp:202-252 - libgromacs_mpi.so.9.0.0 [...] | 0.05 | 0.00 | 0.08 | 0.01 | 0.01 | 0.00 | 12 | 0.01 | 0.00 | |||
| ►Loop 3240 - domdec_specatomcomm.cpp:222-252 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.01 | 0.00 | 0.00 | 0.00 | 1 | 0.00 | 0.00 | |||
| ○Loop 3241 - stl_iterator.h:1054-1054 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.01 | 0.01 | 0.00 | 0.00 | 15 | 0.01 | 0.00 | |||
| ○Loop 3242 - domdec_specatomcomm.cpp:247-252 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 3236 - stl_iterator.h:1028-1182 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3238 - domdec_specatomcomm.cpp:247-252 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3239 - stl_iterator.h:1054-1182 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3237 - stl_iterator.h:1054-1054 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 15 | 0.00 | 0.00 | |||
| ○Loop 3232 - stl_iterator.h:1054-1182 - libgromacs_mpi.so.9.0.0 [...] | 0.02 | 0.02 | 0.01 | 0.01 | 0.00 | 0.00 | 58 | 0.02 | 0.00 | |||
| ►Loop 3233 - domdec_specatomcomm.cpp:222-232 - libgromacs_mpi.so.9.0.0 [...] | 0.03 | 0.00 | 0.04 | 0.01 | 0.00 | 0.00 | 2 | 0.00 | 0.00 | |||
| ○Loop 3235 - domdec_specatomcomm.cpp:229-232 - libgromacs_mpi.so.9.0.0 [...] | 0.02 | 0.02 | 0.02 | 0.02 | 0.00 | 0.00 | 67 | 0.03 | 0.00 | |||
| ○Loop 3234 - domdec_specatomcomm.cpp:229-232 - libgromacs_mpi.so.9.0.0 [...] | 0.01 | 0.01 | 0.01 | 0.01 | 0.00 | 0.00 | 53 | 0.02 | 0.00 | |||
| ○Loop 3225 - domdec_specatomcomm.cpp:285-287 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.01 | 0.01 | 0.00 | 0.00 | 15 | 0.01 | 0.00 | |||
| ○Loop 3210 - domdec_specatomcomm.cpp:351-353 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 3211 - domdec_specatomcomm.cpp:301-323 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3213 - domdec_specatomcomm.cpp:310-315 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3212 - stl_iterator.h:1054-1182 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3227 - domdec_specatomcomm.cpp:285-287 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 1 | 0.00 | 0.00 | |||
| ○Loop 3207 - domdec_specatomcomm.cpp:351-354 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3219 - domdec_specatomcomm.cpp:285-287 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 3215 - stl_iterator.h:1028-1182 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3216 - stl_iterator.h:1054-1182 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3217 - stl_iterator.h:1054-1182 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3229 - domdec_specatomcomm.cpp:285-288 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 1 | 0.00 | 0.00 | |||
| ○Loop 3209 - domdec_specatomcomm.cpp:351-353 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3226 - domdec_specatomcomm.cpp:285-288 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3222 - domdec_specatomcomm.cpp:285-288 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 1 | 0.00 | 0.00 | |||
| ○Loop 3208 - domdec_specatomcomm.cpp:351-354 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3223 - domdec_specatomcomm.cpp:285-288 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 3 | 0.00 | 0.00 | |||
| ○Loop 3218 - domdec_specatomcomm.cpp:285-287 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.01 | 0.01 | 0.00 | 0.00 | 14 | 0.01 | 0.00 | |||
| ○Loop 3214 - domdec_specatomcomm.cpp:320-323 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○atanf | libm.so.6 | 0.07 | 0.07 | 0.06 | 0.06 | 0.01 | 0.01 | 96 | 0.09 | 0.01 | Math (%): 100.00 | |
| ►gmx_sum_qgrid_dd(gmx_pme_t*, float*, int) | libgromacs_mpi.so.9.0.0 | 0.06 | 0.00 | 0.06 | 0.01 | 0.01 | 0.00 | 64 | 0.08 | 0.01 | /home/eoseret/gromacs-2024.2/install_MPI/lib64/libgromacs_mpi.so.9.0.0 (%): 100.00 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 --driver-mode=g++ -D GMX_DOUBLE=0 -D HAVE_CONFIG_H -D TMPI_EXPORTS -D TMPI_USE_VISIBILITY -D USE_STD_INTTYPES_H -D libgromacs_EXPORTS -I /home/eoseret/g... |
| ○Loop 17282 - pme_grid.cpp:191-247 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 4 | 0.00 | 0.00 | |||
| ►Loop 17277 - pme_grid.cpp:191-256 - libgromacs_mpi.so.9.0.0 [...] | 0.01 | 0.00 | 0.02 | 0.01 | 0.00 | 0.00 | 6 | 0.01 | 0.00 | |||
| ○Loop 17280 - pme_grid.cpp:254-256 - libgromacs_mpi.so.9.0.0 | 0.01 | 0.01 | 0.01 | 0.01 | 0.00 | 0.00 | 33 | 0.02 | 0.00 | |||
| ○Loop 17278 - pme_grid.cpp:254-256 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17281 - pme_grid.cpp:254-256 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17279 - pme_grid.cpp:254-256 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 17283 - pme_grid.cpp:80-177 - libgromacs_mpi.so.9.0.0 [...] | 0.05 | 0.00 | 0.13 | 0.01 | 0.01 | 0.00 | 12 | 0.01 | 0.00 | |||
| ►Loop 17284 - pme_grid.cpp:160-172 - libgromacs_mpi.so.9.0.0 | 0.01 | 0.00 | 0.04 | 0.00 | 0.00 | 0.00 | 2 | 0.00 | 0.00 | |||
| ►Loop 17285 - pme_grid.cpp:163-172 - libgromacs_mpi.so.9.0.0 | 0.01 | 0.00 | 0.03 | 0.01 | 0.00 | 0.00 | 10 | 0.01 | 0.00 | |||
| ○Loop 17288 - pme_grid.cpp:166-172 - libgromacs_mpi.so.9.0.0 | 0.01 | 0.01 | 0.02 | 0.02 | 0.00 | 0.00 | 42 | 0.03 | 0.00 | |||
| ○Loop 17287 - pme_grid.cpp:166-172 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17286 - pme_grid.cpp:166-172 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 17289 - pme_grid.cpp:160-177 - libgromacs_mpi.so.9.0.0 [...] | 0.01 | 0.00 | 0.03 | 0.00 | 0.00 | 0.00 | 3 | 0.00 | 0.00 | |||
| ►Loop 17290 - pme_grid.cpp:163-177 - libgromacs_mpi.so.9.0.0 [...] | 0.01 | 0.00 | 0.03 | 0.01 | 0.00 | 0.00 | 6 | 0.01 | 0.00 | |||
| ○Loop 17291 - pme_grid.cpp:166-177 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17292 - pme_grid.cpp:166-177 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17293 - pme_grid.cpp:166-177 - libgromacs_mpi.so.9.0.0 [...] | 0.01 | 0.01 | 0.02 | 0.02 | 0.00 | 0.00 | 35 | 0.03 | 0.00 | |||
| ►Loop 17294 - pme_grid.cpp:117-127 - libgromacs_mpi.so.9.0.0 | 0.02 | 0.00 | 0.04 | 0.00 | 0.00 | 0.00 | 2 | 0.00 | 0.00 | |||
| ►Loop 17295 - pme_grid.cpp:120-127 - libgromacs_mpi.so.9.0.0 | 0.02 | 0.00 | 0.04 | 0.01 | 0.00 | 0.00 | 6 | 0.01 | 0.00 | |||
| ○Loop 17296 - pme_grid.cpp:123-127 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17298 - pme_grid.cpp:123-127 - libgromacs_mpi.so.9.0.0 | 0.02 | 0.02 | 0.03 | 0.03 | 0.00 | 0.00 | 53 | 0.04 | 0.01 | |||
| ○Loop 17297 - pme_grid.cpp:123-127 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►.omp_outlined.#0xb09d40 | libgromacs_mpi.so.9.0.0 | 0.06 | 0.00 | 0.04 | 0.00 | 0.01 | 0.00 | 117 | 0.05 | 0.01 | /home/eoseret/gromacs-2024.2/install_MPI/lib64/libgromacs_mpi.so.9.0.0 (%): 100.00 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 --driver-mode=g++ -D GMX_DOUBLE=0 -D HAVE_CONFIG_H -D TMPI_EXPORTS -D TMPI_USE_VISIBILITY -D USE_STD_INTTYPES_H -D libgromacs_EXPORTS -I /home/eoseret/g... |
| ►Loop 1428 - mdatoms.cpp:268-438 - libgromacs_mpi.so.9.0.0 [...] | 0.06 | 0.06 | 0.04 | 0.04 | 0.01 | 0.01 | 116 | 0.05 | 0.01 | |||
| ○Loop 1427 - mtop_lookup.h:93-106 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 5 | 0.00 | 0.00 | |||
| ►gmx_pme_receive_f(gmx::PmePpCommGpu*, t_commrec const*, gmx::ForceWithVirial*, float*, float*, float*, float*, bool, bool, float*) | libgromacs_mpi.so.9.0.0 | 0.05 | 0.00 | 0.04 | 0.01 | 0.01 | 0.00 | 118 | 0.05 | 0.01 | /home/eoseret/gromacs-2024.2/install_MPI/lib64/libgromacs_mpi.so.9.0.0 (%): 100.00 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 --driver-mode=g++ -D GMX_DOUBLE=0 -D HAVE_CONFIG_H -D TMPI_EXPORTS -D TMPI_USE_VISIBILITY -D USE_STD_INTTYPES_H -D libgromacs_EXPORTS -I /home/eoseret/g... |
| ○Loop 17416 - pme_pp.cpp:604-604 - libgromacs_mpi.so.9.0.0 [...] | 0.05 | 0.05 | 0.04 | 0.04 | 0.01 | 0.01 | 117 | 0.05 | 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 | 0.05 | 0.05 | 0.06 | 0.06 | 0.01 | 0.01 | 86 | 0.07 | 0.01 | /home/eoseret/gromacs-2024.2/install_MPI/lib64/libgromacs_mpi.so.9.0.0 (%): 100.00 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 --driver-mode=g++ -D GMX_DOUBLE=0 -D HAVE_CONFIG_H -D TMPI_EXPORTS -D TMPI_USE_VISIBILITY -D USE_STD_INTTYPES_H -D libgromacs_EXPORTS -I /home/eoseret/g... |
| ►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 | 0.05 | 0.00 | 0.04 | 0.00 | 0.01 | 0.00 | 112 | 0.05 | 0.01 | /home/eoseret/gromacs-2024.2/install_MPI/lib64/libgromacs_mpi.so.9.0.0 (%): 100.00 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 --driver-mode=g++ -D GMX_DOUBLE=0 -D HAVE_CONFIG_H -D TMPI_EXPORTS -D TMPI_USE_VISIBILITY -D USE_STD_INTTYPES_H -D libgromacs_EXPORTS -I /home/eoseret/g... |
| ►Loop 3325 - localtopology.cpp:738-788 - libgromacs_mpi.so.9.0.0 [...] | 0.05 | 0.01 | 0.07 | 0.01 | 0.01 | 0.00 | 48 | 0.01 | 0.00 | |||
| ►Loop 3326 - localtopology.cpp:778-778 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3327 - hashedmap.h:277-282 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 3329 - range.h:123-123 - libgromacs_mpi.so.9.0.0 [...] | 0.04 | 0.02 | 0.06 | 0.03 | 0.01 | 0.00 | 69 | 0.03 | 0.01 | |||
| ○Loop 3330 - hashedmap.h:277-282 - libgromacs_mpi.so.9.0.0 [...] | 0.02 | 0.02 | 0.03 | 0.03 | 0.00 | 0.00 | 79 | 0.03 | 0.00 | |||
| ○Loop 3328 - stl_algobase.h:2067-2081 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○MPI_Waitall | libmpi.so.12.0.0 | 0.05 | 0.05 | 0.03 | 0.03 | 0.01 | 0.01 | 130 | 0.04 | 0.01 | MPI (%): 100.00 | |
| ○MPIDI_GPU_request_free | libmpi.so.12.0.0 | 0.05 | 0.05 | 0.04 | 0.04 | 0.01 | 0.01 | 132 | 0.05 | 0.01 | MPI (%): 100.00 | |
| ►.omp_outlined.#0x6c2070 | libgromacs_mpi.so.9.0.0 | 0.05 | 0.00 | 0.03 | 0.00 | 0.01 | 0.00 | 114 | 0.04 | 0.01 | /home/eoseret/gromacs-2024.2/install_MPI/lib64/libgromacs_mpi.so.9.0.0 (%): 100.00 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 --driver-mode=g++ -D GMX_DOUBLE=0 -D HAVE_CONFIG_H -D TMPI_EXPORTS -D TMPI_USE_VISIBILITY -D USE_STD_INTTYPES_H -D libgromacs_EXPORTS -I /home/eoseret/g... |
| ►Loop 1546 - partition.cpp:1436-2053 - libgromacs_mpi.so.9.0.0 [...] | 0.05 | 0.00 | 0.06 | 0.00 | 0.01 | 0.00 | 1 | 0.00 | 0.00 | |||
| ►Loop 1547 - partition.cpp:1436-2050 - libgromacs_mpi.so.9.0.0 [...] | 0.05 | 0.04 | 0.05 | 0.03 | 0.01 | 0.01 | 113 | 0.04 | 0.01 | |||
| ○Loop 1564 - partition.cpp:1667-1669 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 4 | 0.00 | 0.00 | |||
| ○Loop 1551 - hashedmap.h:277-282 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 1552 - stl_algobase.h:2067-2081 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 1554 - hashedmap.h:277-282 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 1553 - hashedmap.h:277-282 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 1555 - hashedmap.h:277-282 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 1556 - hashedmap.h:277-282 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 1562 - partition.cpp:1680-1688 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 3 | 0.00 | 0.00 | |||
| ○Loop 1548 - stl_uninitialized.h:1031-1031 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 1563 - partition.cpp:1667-1669 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 1561 - partition.cpp:1680-1685 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 1558 - partition.cpp:1741-1743 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.01 | 0.01 | 0.00 | 0.00 | 4 | 0.02 | 0.00 | |||
| ○Loop 1560 - partition.cpp:1698-1700 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 1 | 0.00 | 0.00 | |||
| ○Loop 1559 - partition.cpp:1698-1700 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 1550 - hashedmap.h:277-282 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 1557 - partition.cpp:1741-1743 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 1549 - hashedmap.h:277-282 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►copy_fftgrid_to_pmegrid(gmx_pme_t*, float const*, float*, int, int, int) | libgromacs_mpi.so.9.0.0 | 0.05 | 0.00 | 0.04 | 0.00 | 0.01 | 0.00 | 64 | 0.07 | 0.01 | /home/eoseret/gromacs-2024.2/install_MPI/lib64/libgromacs_mpi.so.9.0.0 (%): 100.00 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 --driver-mode=g++ -D GMX_DOUBLE=0 -D HAVE_CONFIG_H -D TMPI_EXPORTS -D TMPI_USE_VISIBILITY -D USE_STD_INTTYPES_H -D libgromacs_EXPORTS -I /home/eoseret/g... |
| ►Loop 17305 - pme_grid.cpp:395-404 - libgromacs_mpi.so.9.0.0 | 0.05 | 0.01 | 0.05 | 0.01 | 0.01 | 0.00 | 32 | 0.01 | 0.00 | |||
| ○Loop 17308 - pme_grid.cpp:402-404 - libgromacs_mpi.so.9.0.0 | 0.04 | 0.04 | 0.04 | 0.04 | 0.01 | 0.01 | 64 | 0.06 | 0.01 | |||
| ○Loop 17306 - pme_grid.cpp:402-404 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17307 - pme_grid.cpp:402-404 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17309 - pme_grid.cpp:402-404 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►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 | 0.00 | 0.04 | 0.00 | 0.01 | 0.00 | 85 | 0.07 | 0.01 | /home/eoseret/gromacs-2024.2/install_MPI/lib64/libgromacs_mpi.so.9.0.0 (%): 100.00 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 --driver-mode=g++ -D GMX_DOUBLE=0 -D HAVE_CONFIG_H -D TMPI_EXPORTS -D TMPI_USE_VISIBILITY -D USE_STD_INTTYPES_H -D libgromacs_EXPORTS -I /home/eoseret/g... |
| ○Loop 16899 - functions.h:164-321 - libgromacs_mpi.so.9.0.0 [...] | 0.05 | 0.05 | 0.04 | 0.04 | 0.01 | 0.01 | 85 | 0.07 | 0.01 | |||
| ○__acosf_finite | libm.so.6 | 0.04 | 0.04 | 0.05 | 0.05 | 0.01 | 0.01 | 83 | 0.06 | 0.01 | Math (%): 100.00 | |
| ►.omp_outlined. | libgromacs_mpi.so.9.0.0 | 0.04 | 0.00 | 0.03 | 0.00 | 0.01 | 0.00 | 110 | 0.03 | 0.01 | /home/eoseret/gromacs-2024.2/install_MPI/lib64/libgromacs_mpi.so.9.0.0 (%): 100.00 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 --driver-mode=g++ -D GMX_DOUBLE=0 -D HAVE_CONFIG_H -D TMPI_EXPORTS -D TMPI_USE_VISIBILITY -D USE_STD_INTTYPES_H -D libgromacs_EXPORTS -I /home/eoseret/g... |
| ►Loop 1597 - atomdata.cpp:961-982 - libgromacs_mpi.so.9.0.0 [...] | 0.04 | 0.00 | 0.04 | 0.00 | 0.01 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 1598 - atomdata.cpp:965-982 - libgromacs_mpi.so.9.0.0 [...] | 0.04 | 0.00 | 0.04 | 0.01 | 0.01 | 0.00 | 27 | 0.01 | 0.00 | |||
| ○Loop 1599 - atomdata.cpp:973-982 - libgromacs_mpi.so.9.0.0 [...] | 0.03 | 0.03 | 0.02 | 0.02 | 0.01 | 0.01 | 100 | 0.03 | 0.00 | |||
| ►copy_pmegrid_to_fftgrid(gmx_pme_t const*, float const*, float*, int) | libgromacs_mpi.so.9.0.0 | 0.04 | 0.00 | 0.04 | 0.00 | 0.01 | 0.00 | 63 | 0.06 | 0.01 | /home/eoseret/gromacs-2024.2/install_MPI/lib64/libgromacs_mpi.so.9.0.0 (%): 100.00 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 --driver-mode=g++ -D GMX_DOUBLE=0 -D HAVE_CONFIG_H -D TMPI_EXPORTS -D TMPI_USE_VISIBILITY -D USE_STD_INTTYPES_H -D libgromacs_EXPORTS -I /home/eoseret/g... |
| ►Loop 17299 - pme_grid.cpp:299-309 - libgromacs_mpi.so.9.0.0 | 0.04 | 0.00 | 0.06 | 0.00 | 0.01 | 0.00 | 1 | 0.00 | 0.00 | |||
| ►Loop 17300 - pme_grid.cpp:301-309 - libgromacs_mpi.so.9.0.0 | 0.04 | 0.00 | 0.06 | 0.01 | 0.01 | 0.00 | 23 | 0.01 | 0.00 | |||
| ○Loop 17304 - pme_grid.cpp:303-309 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17302 - pme_grid.cpp:303-309 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17303 - pme_grid.cpp:303-309 - libgromacs_mpi.so.9.0.0 [...] | 0.03 | 0.03 | 0.04 | 0.04 | 0.01 | 0.01 | 62 | 0.05 | 0.01 | |||
| ○Loop 17301 - pme_grid.cpp:303-309 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►.omp_outlined..17 | libgromacs_mpi.so.9.0.0 | 0.04 | 0.00 | 0.04 | 0.01 | 0.01 | 0.00 | 92 | 0.05 | 0.01 | /home/eoseret/gromacs-2024.2/install_MPI/lib64/libgromacs_mpi.so.9.0.0 (%): 100.00 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 --driver-mode=g++ -D GMX_DOUBLE=0 -D HAVE_CONFIG_H -D TMPI_EXPORTS -D TMPI_USE_VISIBILITY -D USE_STD_INTTYPES_H -D libgromacs_EXPORTS -I /home/eoseret/g... |
| ►Loop 4163 - threaded_force_buffer.cpp:171-211 - libgromacs_mpi.so.9.0.0 [...] | 0.04 | 0.01 | 0.05 | 0.01 | 0.01 | 0.00 | 48 | 0.02 | 0.00 | |||
| ○Loop 4169 - vec.h:141-147 - libgromacs_mpi.so.9.0.0 | 0.02 | 0.02 | 0.02 | 0.02 | 0.00 | 0.00 | 80 | 0.03 | 0.00 | |||
| ►Loop 4164 - threaded_force_buffer.cpp:207-211 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 4166 - threaded_force_buffer.cpp:209-211 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 4165 - threaded_force_buffer.cpp:209-211 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 4168 - threaded_force_buffer.cpp:200-200 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 4170 - vec.h:141-147 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 3 | 0.00 | 0.00 | |||
| ○Loop 4167 - threaded_force_buffer.cpp:200-200 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.01 | 0.01 | 0.00 | 0.00 | 15 | 0.01 | 0.00 | |||
| ○Loop 4171 - threaded_force_buffer.cpp:182-186 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►.omp_outlined..65 | libgromacs_mpi.so.9.0.0 | 0.04 | 0.00 | 0.03 | 0.01 | 0.01 | 0.00 | 103 | 0.04 | 0.01 | /home/eoseret/gromacs-2024.2/install_MPI/lib64/libgromacs_mpi.so.9.0.0 (%): 100.00 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 --driver-mode=g++ -D GMX_DOUBLE=0 -D HAVE_CONFIG_H -D TMPI_EXPORTS -D TMPI_USE_VISIBILITY -D USE_STD_INTTYPES_H -D libgromacs_EXPORTS -I /home/eoseret/g... |
| ○Loop 15389 - update.cpp:1703-1706 - libgromacs_mpi.so.9.0.0 [...] | 0.03 | 0.03 | 0.03 | 0.03 | 0.01 | 0.01 | 102 | 0.03 | 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 | 0.04 | 0.00 | 0.03 | 0.00 | 0.01 | 0.00 | 103 | 0.03 | 0.01 | /home/eoseret/gromacs-2024.2/install_MPI/lib64/libgromacs_mpi.so.9.0.0 (%): 100.00 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 --driver-mode=g++ -D GMX_DOUBLE=0 -D HAVE_CONFIG_H -D TMPI_EXPORTS -D TMPI_USE_VISIBILITY -D USE_STD_INTTYPES_H -D libgromacs_EXPORTS -I /home/eoseret/g... |
| ○Loop 1796 - grid.cpp:416-421 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.01 | 0.01 | 0.00 | 0.00 | 4 | 0.00 | 0.00 | |||
| ►Loop 1800 - grid.cpp:330-408 - libgromacs_mpi.so.9.0.0 [...] | 0.01 | 0.01 | 0.02 | 0.01 | 0.00 | 0.00 | 40 | 0.02 | 0.00 | |||
| ○Loop 1802 - grid.cpp:398-401 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 1801 - grid.cpp:386-388 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 10 | 0.00 | 0.00 | |||
| ○Loop 1797 - grid.cpp:416-421 - libgromacs_mpi.so.9.0.0 | 0.02 | 0.02 | 0.02 | 0.02 | 0.00 | 0.00 | 81 | 0.03 | 0.00 | |||
| ○Loop 1799 - grid.cpp:427-432 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 1798 - grid.cpp:427-432 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○__I_MPI___intel_avx_rep_memcpy | libmpifort.so.12.0.0 | 0.03 | 0.03 | 0.02 | 0.02 | 0.01 | 0.01 | 117 | 0.03 | 0.00 | MPI (%): 100.00 | |
| ►.omp_outlined..70 | libgromacs_mpi.so.9.0.0 | 0.03 | 0.00 | 0.03 | 0.01 | 0.01 | 0.00 | 102 | 0.03 | 0.01 | /home/eoseret/gromacs-2024.2/install_MPI/lib64/libgromacs_mpi.so.9.0.0 (%): 100.00 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 --driver-mode=g++ -D GMX_DOUBLE=0 -D HAVE_CONFIG_H -D TMPI_EXPORTS -D TMPI_USE_VISIBILITY -D USE_STD_INTTYPES_H -D libgromacs_EXPORTS -I /home/eoseret/g... |
| ○Loop 15394 - exception_ptr.h:200-201 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 15419 - update.cpp:379-405 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 15399 - update.cpp:615-686 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 15397 - charconv.h:58-62 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 15410 - update.cpp:394-405 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 15402 - update.cpp:615-686 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 15431 - update.cpp:972-988 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 15417 - update.cpp:394-405 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 15413 - update.cpp:383-405 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 15407 - update.cpp:394-405 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 15406 - update.cpp:394-405 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 15408 - update.cpp:379-405 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 15424 - update.cpp:383-405 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 15396 - charconv.h:84-89 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 15393 - exception_ptr.h:200-201 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 15415 - update.cpp:498-501 - libgromacs_mpi.so.9.0.0 [...] | 0.02 | 0.02 | 0.02 | 0.02 | 0.00 | 0.00 | 86 | 0.03 | 0.00 | |||
| ○Loop 15423 - update.cpp:383-405 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 15409 - update.cpp:394-405 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 15411 - update.cpp:379-405 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 15426 - update.cpp:1354-1395 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 15427 - update.cpp:1354-1395 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 15400 - update.cpp:615-686 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 15395 - exception_ptr.h:200-201 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 15404 - update.cpp:615-686 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 15418 - update.cpp:394-405 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 15430 - cmath:464-464 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 15403 - update.cpp:619-686 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 15433 - update.cpp:916-937 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 15398 - update.cpp:615-686 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 15434 - update.cpp:916-937 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 15420 - update.cpp:394-405 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 15391 - exception_ptr.h:200-201 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 15432 - update.cpp:972-988 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 15414 - update.cpp:379-405 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 15392 - exception_ptr.h:200-201 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 15412 - update.cpp:383-405 - libgromacs_mpi.so.9.0.0 [...] | 0.01 | 0.01 | 0.01 | 0.01 | 0.00 | 0.00 | 30 | 0.01 | 0.00 | |||
| ○Loop 15422 - update.cpp:379-405 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 15401 - update.cpp:658-686 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 15428 - update.cpp:1172-1233 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 15429 - update.cpp:1191-1233 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 15421 - update.cpp:394-405 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 15416 - update.cpp:498-501 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 15390 - exception_ptr.h:200-201 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 15425 - update.cpp:379-405 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 15405 - update.cpp:615-686 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○MPID_Progress_idle_timer_tick | libmpi.so.12.0.0 | 0.03 | 0.03 | 0.04 | 0.04 | 0.01 | 0.01 | 100 | 0.04 | 0.01 | MPI (%): 100.00 | |
| ►.omp_outlined..4 | libgromacs_mpi.so.9.0.0 | 0.03 | 0.00 | 0.04 | 0.01 | 0.01 | 0.00 | 98 | 0.04 | 0.01 | /home/eoseret/gromacs-2024.2/install_MPI/lib64/libgromacs_mpi.so.9.0.0 (%): 100.00 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 --driver-mode=g++ -D GMX_DOUBLE=0 -D HAVE_CONFIG_H -D TMPI_EXPORTS -D TMPI_USE_VISIBILITY -D USE_STD_INTTYPES_H -D libgromacs_EXPORTS -I /home/eoseret/g... |
| ►Loop 14999 - md_support.cpp:148-219 - libgromacs_mpi.so.9.0.0 [...] | 0.03 | 0.00 | 0.04 | 0.00 | 0.01 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 15002 - md_support.cpp:181-209 - libgromacs_mpi.so.9.0.0 [...] | 0.03 | 0.03 | 0.04 | 0.04 | 0.01 | 0.01 | 97 | 0.04 | 0.01 | |||
| ○Loop 15000 - md_support.cpp:181-209 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 15003 - md_support.cpp:181-219 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 15001 - md_support.cpp:181-219 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 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 | 0.03 | 0.00 | 0.04 | 0.01 | 0.01 | 0.00 | 101 | 0.04 | 0.01 | /home/eoseret/gromacs-2024.2/install_MPI/lib64/libgromacs_mpi.so.9.0.0 (%): 100.00 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 --driver-mode=g++ -D GMX_DOUBLE=0 -D HAVE_CONFIG_H -D TMPI_EXPORTS -D TMPI_USE_VISIBILITY -D USE_STD_INTTYPES_H -D libgromacs_EXPORTS -I /home/eoseret/g... |
| ○Loop 3415 - partition.cpp:630-630 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3478 - partition.cpp:449-451 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3535 - partition.cpp:726-733 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 1 | 0.00 | 0.00 | |||
| ○Loop 3483 - hashedmap.h:290-293 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3541 - partition.cpp:449-449 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3481 - partition.cpp:449-449 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3490 - stl_algobase.h:383-385 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3491 - stl_algobase.h:385-385 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3543 - partition.cpp:469-471 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 3513 - partition.cpp:171-384 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 2 | 0.00 | 0.00 | |||
| ○Loop 3533 - partition.cpp:186-200 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3532 - partition.cpp:186-200 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 3514 - partition.cpp:174-384 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3519 - partition.cpp:353-356 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3516 - partition.cpp:377-379 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3520 - partition.cpp:351-355 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3517 - partition.cpp:361-363 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3515 - partition.cpp:377-379 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3521 - partition.cpp:274-337 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3522 - partition.cpp:276-299 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3518 - partition.cpp:361-363 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3531 - partition.cpp:186-198 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 3523 - partition.cpp:233-251 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3524 - partition.cpp:247-251 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3525 - partition.cpp:249-251 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3526 - partition.cpp:249-251 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 3527 - partition.cpp:233-251 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3528 - partition.cpp:247-251 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3529 - partition.cpp:249-251 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3530 - partition.cpp:249-251 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3544 - partition.cpp:469-471 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3492 - stl_algobase.h:385-385 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3480 - partition.cpp:449-449 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3505 - partition.cpp:449-451 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3487 - stl_algobase.h:385-385 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3498 - stl_algobase.h:383-385 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 3 | 0.00 | 0.00 | |||
| ○Loop 3510 - partition.cpp:425-428 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3511 - partition.cpp:427-428 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3545 - partition.cpp:469-471 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3497 - partition.cpp:2522-2524 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3548 - partition.cpp:647-649 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3496 - partition.cpp:2522-2524 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3420 - partition.cpp:577-619 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3503 - partition.cpp:2522-2524 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3421 - partition.cpp:555-569 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 3537 - utility.h:82-89 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3536 - utility.h:82-82 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3552 - partition.cpp:1183-1187 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3542 - partition.cpp:469-471 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3477 - new_allocator.h:145-145 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3506 - partition.cpp:449-451 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 3546 - hashedmap.h:229-255 - libgromacs_mpi.so.9.0.0 [...] | 0.02 | 0.01 | 0.03 | 0.02 | 0.00 | 0.00 | 61 | 0.02 | 0.00 | |||
| ○Loop 3547 - hashedmap.h:232-255 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.01 | 0.01 | 0.00 | 0.00 | 5 | 0.02 | 0.00 | |||
| ○Loop 3508 - partition.cpp:449-449 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3504 - partition.cpp:2557-2561 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 4 | 0.00 | 0.00 | |||
| ○Loop 3549 - partition.cpp:647-649 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3500 - partition.cpp:2522-2524 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3493 - partition.cpp:2522-2524 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 3 | 0.00 | 0.00 | |||
| ○Loop 3509 - partition.cpp:425-428 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 3418 - hashedmap.h:274-282 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3419 - hashedmap.h:277-282 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3512 - partition.cpp:425-435 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3482 - hashedmap.h:292-293 - libgromacs_mpi.so.9.0.0 | 0.01 | 0.01 | 0.02 | 0.02 | 0.00 | 0.00 | 33 | 0.02 | 0.00 | |||
| ○Loop 3424 - partition.cpp:2206-2208 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3540 - partition.cpp:449-449 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3539 - partition.cpp:449-451 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 3425 - partition.cpp:1360-2189 - libgromacs_mpi.so.9.0.0 [...] | 0.01 | 0.00 | 0.04 | 0.00 | 0.00 | 0.00 | 1 | 0.00 | 0.00 | |||
| ○Loop 3474 - partition.cpp:1924-1926 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3472 - partition.cpp:1924-1928 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3473 - partition.cpp:1924-1926 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 3433 - partition.cpp:1421-1427 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3432 - partition.cpp:1423-1427 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 3426 - partition.cpp:1360-2180 - libgromacs_mpi.so.9.0.0 [...] | 0.01 | 0.00 | 0.03 | 0.00 | 0.00 | 0.00 | 5 | 0.00 | 0.00 | |||
| ►Loop 3437 - partition.cpp:1361-1387 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3449 - partition.cpp:1369-1373 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 3438 - partition.cpp:1376-1387 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3439 - partition.cpp:1385-1387 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3441 - partition.cpp:1385-1387 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3440 - partition.cpp:1385-1387 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 3443 - partition.cpp:1376-1387 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3448 - partition.cpp:1380-1382 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3446 - partition.cpp:1387-1387 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3442 - partition.cpp:1380-1382 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3445 - partition.cpp:1385-1387 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3444 - partition.cpp:1387-1387 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3447 - partition.cpp:1380-1382 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3457 - partition.cpp:2095-2099 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3459 - partition.cpp:2095-2099 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 3461 - partition.cpp:1959-2075 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 3470 - partition.cpp:1968-1984 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3471 - partition.cpp:1973-1981 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 1 | 0.00 | 0.00 | |||
| ►Loop 3462 - stl_algobase.h:429-742 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3468 - stl_uninitialized.h:91-91 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3467 - stl_uninitialized.h:91-91 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3463 - stl_uninitialized.h:91-91 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3466 - stl_uninitialized.h:91-91 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3465 - stl_uninitialized.h:91-91 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3469 - stl_uninitialized.h:91-91 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3464 - stl_uninitialized.h:91-91 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3460 - partition.cpp:2079-2081 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3458 - partition.cpp:2095-2099 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 3434 - partition.cpp:1396-1411 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 3436 - utility.h:82-89 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3435 - utility.h:82-82 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 3450 - partition.cpp:2150-2164 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.02 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 3452 - utility.h:82-89 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.02 | 0.01 | 0.00 | 0.00 | 24 | 0.01 | 0.00 | |||
| ○Loop 3451 - utility.h:82-82 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.01 | 0.01 | 0.00 | 0.00 | 2 | 0.00 | 0.00 | |||
| ○Loop 3456 - stl_uninitialized.h:1031-1031 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 3453 - partition.cpp:2150-2164 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.01 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 3455 - utility.h:82-89 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.01 | 0.00 | 0.00 | 0.00 | 1 | 0.00 | 0.00 | |||
| ○Loop 3454 - utility.h:82-82 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 1 | 0.00 | 0.00 | |||
| ►Loop 3431 - partition.cpp:1421-1427 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3427 - partition.cpp:1423-1427 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3428 - partition.cpp:1423-1427 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3430 - partition.cpp:1423-1427 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3429 - partition.cpp:1423-1427 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3494 - partition.cpp:2522-2524 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3484 - ga2la.h:158-158 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3485 - ga2la.h:156-158 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3495 - stl_algobase.h:383-385 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 3554 - partition.cpp:666-918 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3555 - partition.cpp:779-912 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 3475 - partition.cpp:1504-1514 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3476 - partition.cpp:1507-1514 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 1 | 0.00 | 0.00 | |||
| ○Loop 3534 - partition.cpp:150-163 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3507 - partition.cpp:449-449 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3499 - partition.cpp:2522-2524 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 4 | 0.00 | 0.00 | |||
| ○Loop 3423 - partition.cpp:2217-2221 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3502 - partition.cpp:2522-2524 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 1 | 0.00 | 0.00 | |||
| ○Loop 3538 - partition.cpp:449-451 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3501 - stl_algobase.h:383-385 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 1 | 0.00 | 0.00 | |||
| ○Loop 3416 - mdmodulesnotifier.h:107-107 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3488 - partition.cpp:2522-2524 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 2 | 0.00 | 0.00 | |||
| ○Loop 3489 - partition.cpp:2522-2524 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3417 - partition.cpp:615-624 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3422 - partition.cpp:3195-3197 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3479 - partition.cpp:449-451 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 3551 - utility.h:82-89 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3550 - utility.h:82-82 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3553 - partition.cpp:932-936 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3486 - stl_algobase.h:383-385 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○mkl_dft_def_ownscDftFwd_PrimeFact_32fc | libmkl_def.so.2 | 0.03 | 0.03 | 0.04 | 0.04 | 0.00 | 0.00 | 60 | 0.06 | 0.01 | Math (%): 100.00 | |
| ○MPIR_Sendrecv_impl | libmpi.so.12.0.0 | 0.03 | 0.03 | 0.02 | 0.02 | 0.00 | 0.00 | 115 | 0.03 | 0.00 | MPI (%): 100.00 | |
| ►getVerletBufferAtomtypes(gmx_mtop_t const&, bool, bool) | libgromacs_mpi.so.9.0.0 | 0.03 | 0.00 | 0.02 | 0.00 | 0.00 | 0.00 | 99 | 0.03 | 0.00 | /home/eoseret/gromacs-2024.2/install_MPI/lib64/libgromacs_mpi.so.9.0.0 (%): 100.00 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 --driver-mode=g++ -D GMX_DOUBLE=0 -D HAVE_CONFIG_H -D TMPI_EXPORTS -D TMPI_USE_VISIBILITY -D USE_STD_INTTYPES_H -D libgromacs_EXPORTS -I /home/eoseret/g... |
| ►Loop 14184 - stl_vector.h:353-353 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 14186 - stl_vector.h:353-353 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 14187 - stl_vector.h:353-353 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 14185 - stl_vector.h:353-353 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 14192 - new_allocator.h:111-162 - libgromacs_mpi.so.9.0.0 [...] | 0.03 | 0.00 | 0.05 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 14205 - vector.tcc:112-504 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 14207 - calc_verletbuf.cpp:167-500 - libgromacs_mpi.so.9.0.0 [...] | 0.01 | 0.00 | 0.02 | 0.01 | 0.00 | 0.00 | 1 | 0.00 | 0.00 | |||
| ○Loop 14209 - calc_verletbuf.cpp:167-500 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 14208 - calc_verletbuf.cpp:167-500 - libgromacs_mpi.so.9.0.0 [...] | 0.01 | 0.01 | 0.01 | 0.01 | 0.00 | 0.00 | 30 | 0.01 | 0.00 | |||
| ○Loop 14210 - stl_uninitialized.h:236-236 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.01 | 0.01 | 0.00 | 0.00 | 7 | 0.01 | 0.00 | |||
| ►Loop 14196 - calc_verletbuf.cpp:169-289 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 14197 - calc_verletbuf.cpp:169-289 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 14198 - calc_verletbuf.cpp:247-249 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 14199 - calc_verletbuf.cpp:247-249 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 14202 - calc_verletbuf.cpp:203-203 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 14201 - calc_verletbuf.cpp:200-203 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 14203 - calc_verletbuf.cpp:203-203 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 14204 - calc_verletbuf.cpp:260-277 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 14200 - calc_verletbuf.cpp:169-206 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 14206 - calc_verletbuf.cpp:167-524 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 14211 - stl_uninitialized.h:236-236 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 14193 - calc_verletbuf.cpp:167-548 - libgromacs_mpi.so.9.0.0 [...] | 0.02 | 0.02 | 0.02 | 0.01 | 0.00 | 0.00 | 73 | 0.02 | 0.00 | |||
| ○Loop 14195 - hashtable.h:1840-1843 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.01 | 0.01 | 0.00 | 0.00 | 16 | 0.01 | 0.00 | |||
| ○Loop 14194 - hashtable.h:2386-2403 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 14190 - calc_verletbuf.cpp:557-559 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 14191 - stl_uninitialized.h:1031-1031 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 14212 - calc_verletbuf.cpp:169-404 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.01 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 14213 - calc_verletbuf.cpp:323-404 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 14217 - calc_verletbuf.cpp:325-391 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 14215 - calc_verletbuf.cpp:325-391 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 9 | 0.00 | 0.00 | |||
| ○Loop 14214 - calc_verletbuf.cpp:325-391 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 14216 - calc_verletbuf.cpp:325-391 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 14219 - calc_verletbuf.cpp:323-381 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 14218 - calc_verletbuf.cpp:169-381 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.01 | 0.01 | 0.00 | 0.00 | 7 | 0.01 | 0.00 | |||
| ○Loop 14188 - hashtable_policy.h:287-1916 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 14189 - calc_verletbuf.cpp:564-575 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○mkl_dft_def_ownscDftInv_PrimeFact_32fc | libmkl_def.so.2 | 0.03 | 0.03 | 0.03 | 0.03 | 0.00 | 0.00 | 59 | 0.04 | 0.01 | Math (%): 100.00 | |
| ○MPI_Isend | libmpi.so.12.0.0 | 0.03 | 0.03 | 0.03 | 0.03 | 0.00 | 0.00 | 99 | 0.04 | 0.01 | MPI (%): 100.00 | |
| ○MPIDIG_progress_compl_list | libmpi.so.12.0.0 | 0.03 | 0.03 | 0.02 | 0.02 | 0.00 | 0.00 | 109 | 0.03 | 0.00 | MPI (%): 100.00 | |
| ○MPI_T_category_get_pvars | libmpi.so.12.0.0 | 0.03 | 0.03 | 0.04 | 0.04 | 0.00 | 0.00 | 99 | 0.03 | 0.01 | MPI (%): 100.00 | |
| ►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 | 0.03 | 0.00 | 0.06 | 0.00 | 0.00 | 0.00 | 42 | 0.10 | 0.02 | /home/eoseret/gromacs-2024.2/install_MPI/lib64/libgromacs_mpi.so.9.0.0 (%): 100.00 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 --driver-mode=g++ -D GMX_DOUBLE=0 -D HAVE_CONFIG_H -D TMPI_EXPORTS -D TMPI_USE_VISIBILITY -D USE_STD_INTTYPES_H -D libgromacs_EXPORTS -I /home/eoseret/g... |
| ►Loop 16803 - bonded.cpp:2179-2256 - libgromacs_mpi.so.9.0.0 [...] | 0.03 | 0.02 | 0.07 | 0.06 | 0.00 | 0.00 | 39 | 0.09 | 0.01 | |||
| ○Loop 16804 - bonded.cpp:2185-2213 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.01 | 0.01 | 0.00 | 0.00 | 16 | 0.01 | 0.00 | |||
| ○__kmp_fork_call | libomp.so | 0.03 | 0.00 | 0.02 | 0.00 | 0.00 | 0.00 | 113 | 0.02 | 0.00 | OMP (%): 100.00 | |
| ►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 | 0.03 | 0.00 | 0.03 | 0.00 | 0.00 | 0.00 | 87 | 0.04 | 0.01 | /home/eoseret/gromacs-2024.2/install_MPI/lib64/libgromacs_mpi.so.9.0.0 (%): 100.00 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 --driver-mode=g++ -D GMX_DOUBLE=0 -D HAVE_CONFIG_H -D TMPI_EXPORTS -D TMPI_USE_VISIBILITY -D USE_STD_INTTYPES_H -D libgromacs_EXPORTS -I /home/eoseret/g... |
| ►Loop 3243 - hashedmap.h:274-282 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3244 - hashedmap.h:277-282 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3257 - vector.tcc:617-680 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 3245 - hashedmap.h:274-282 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3246 - hashedmap.h:277-282 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 3247 - domdec_specatomcomm.cpp:438-566 - libgromacs_mpi.so.9.0.0 [...] | 0.03 | 0.00 | 0.06 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 3251 - vector.tcc:464-680 - libgromacs_mpi.so.9.0.0 [...] | 0.03 | 0.00 | 0.06 | 0.00 | 0.00 | 0.00 | 1 | 0.00 | 0.00 | |||
| ○Loop 3253 - domdec_specatomcomm.cpp:503-503 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 1 | 0.00 | 0.00 | |||
| ►Loop 3254 - hashedmap.h:274-282 - libgromacs_mpi.so.9.0.0 [...] | 0.03 | 0.01 | 0.05 | 0.03 | 0.00 | 0.00 | 33 | 0.03 | 0.00 | |||
| ○Loop 3256 - hashedmap.h:277-282 - libgromacs_mpi.so.9.0.0 [...] | 0.01 | 0.01 | 0.02 | 0.02 | 0.00 | 0.00 | 59 | 0.02 | 0.00 | |||
| ○Loop 3255 - hashedmap.h:277-282 - libgromacs_mpi.so.9.0.0 [...] | 0.01 | 0.01 | 0.01 | 0.01 | 0.00 | 0.00 | 28 | 0.01 | 0.00 | |||
| ○Loop 3252 - domdec_specatomcomm.cpp:527-529 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 3248 - domdec_specatomcomm.cpp:564-566 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3250 - hashedmap.h:167-170 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3249 - hashedmap.h:187-189 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 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 | 0.03 | 0.03 | 0.03 | 0.03 | 0.00 | 0.00 | 83 | 0.03 | 0.00 | /home/eoseret/gromacs-2024.2/install_MPI/lib64/libgromacs_mpi.so.9.0.0 (%): 100.00 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 --driver-mode=g++ -D GMX_DOUBLE=0 -D HAVE_CONFIG_H -D TMPI_EXPORTS -D TMPI_USE_VISIBILITY -D USE_STD_INTTYPES_H -D libgromacs_EXPORTS -I /home/eoseret/g... |
| ○Loop 15300 - mdmodulesnotifier.h:107-107 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 15297 - sim_util.cpp:491-500 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 15299 - sim_util.cpp:2024-2028 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 1 | 0.00 | 0.00 | |||
| ○Loop 15298 - wallcycle.h:391-498 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►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 | 0.03 | 0.00 | 0.03 | 0.00 | 0.00 | 0.00 | 65 | 0.05 | 0.01 | /home/eoseret/gromacs-2024.2/install_MPI/lib64/libgromacs_mpi.so.9.0.0 (%): 100.00 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 --driver-mode=g++ -D GMX_DOUBLE=0 -D HAVE_CONFIG_H -D TMPI_EXPORTS -D TMPI_USE_VISIBILITY -D USE_STD_INTTYPES_H -D libgromacs_EXPORTS -I /home/eoseret/g... |
| ►Loop 16908 - bonded.cpp:1913-2011 - libgromacs_mpi.so.9.0.0 [...] | 0.03 | 0.01 | 0.04 | 0.01 | 0.00 | 0.00 | 32 | 0.02 | 0.00 | |||
| ○Loop 16909 - bonded.cpp:1913-2008 - libgromacs_mpi.so.9.0.0 [...] | 0.02 | 0.02 | 0.03 | 0.03 | 0.00 | 0.00 | 57 | 0.04 | 0.01 | |||
| ○__kmpc_end_serialized_parallel | libomp.so | 0.03 | 0.03 | 0.02 | 0.02 | 0.00 | 0.00 | 106 | 0.02 | 0.00 | OMP (%): 100.00 | |
| ►gmx::LegacySimulator::do_md() | libgromacs_mpi.so.9.0.0 | 0.03 | 0.00 | 0.02 | 0.00 | 0.00 | 0.00 | 87 | 0.03 | 0.00 | /home/eoseret/gromacs-2024.2/install_MPI/lib64/libgromacs_mpi.so.9.0.0 (%): 100.00 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 --driver-mode=g++ -D GMX_DOUBLE=0 -D HAVE_CONFIG_H -D TMPI_EXPORTS -D TMPI_USE_VISIBILITY -D USE_STD_INTTYPES_H -D libgromacs_EXPORTS -I /home/eoseret/g... |
| ►Loop 17896 - md.cpp:232-2136 - libgromacs_mpi.so.9.0.0 [...] | 0.03 | 0.03 | 0.02 | 0.02 | 0.00 | 0.00 | 87 | 0.03 | 0.00 | |||
| ○Loop 17897 - stophandler.h:153-159 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17894 - new_allocator.h:145-145 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17893 - new_allocator.h:145-145 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17900 - md.cpp:554-566 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17898 - md.cpp:717-717 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17899 - md.cpp:717-717 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17895 - std_function.h:243-244 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17892 - stl_vector.h:335-353 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 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 | 0.02 | 0.02 | 0.03 | 0.03 | 0.00 | 0.00 | 72 | 0.03 | 0.01 | /home/eoseret/gromacs-2024.2/install_MPI/lib64/libgromacs_mpi.so.9.0.0 (%): 100.00 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 --driver-mode=g++ -D GMX_DOUBLE=0 -D HAVE_CONFIG_H -D TMPI_EXPORTS -D TMPI_USE_VISIBILITY -D USE_STD_INTTYPES_H -D libgromacs_EXPORTS -I /home/eoseret/g... |
| ►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 | 0.02 | 0.00 | 0.03 | 0.00 | 0.00 | 0.00 | 82 | 0.03 | 0.00 | /home/eoseret/gromacs-2024.2/install_MPI/lib64/libgromacs_mpi.so.9.0.0 (%): 100.00 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 --driver-mode=g++ -D GMX_DOUBLE=0 -D HAVE_CONFIG_H -D TMPI_EXPORTS -D TMPI_USE_VISIBILITY -D USE_STD_INTTYPES_H -D libgromacs_EXPORTS -I /home/eoseret/g... |
| ►Loop 3317 - localtopology.cpp:104-701 - libgromacs_mpi.so.9.0.0 [...] | 0.02 | 0.01 | 0.03 | 0.02 | 0.00 | 0.00 | 63 | 0.02 | 0.00 | |||
| ○Loop 3318 - stl_algo.h:568-573 - libgromacs_mpi.so.9.0.0 [...] | 0.01 | 0.01 | 0.01 | 0.01 | 0.00 | 0.00 | 36 | 0.01 | 0.00 | |||
| ○do_lookup_x | ld-linux-x86-64.so.2 | 0.02 | 0.02 | 0.01 | 0.01 | 0.00 | 0.00 | 105 | 0.01 | 0.00 | System (%): 100.00 | |
| ○__kmp_serialized_parallel | libomp.so | 0.02 | 0.00 | 0.01 | 0.00 | 0.00 | 0.00 | 85 | 0.02 | 0.00 | OMP (%): 100.00 | |
| ►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 | 0.01 | 0.02 | 0.01 | 0.00 | 0.00 | 78 | 0.02 | 0.00 | /home/eoseret/gromacs-2024.2/install_MPI/lib64/libgromacs_mpi.so.9.0.0 (%): 100.00 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 --driver-mode=g++ -D GMX_DOUBLE=0 -D HAVE_CONFIG_H -D TMPI_EXPORTS -D TMPI_USE_VISIBILITY -D USE_STD_INTTYPES_H -D libgromacs_EXPORTS -I /home/eoseret/g... |
| ○Loop 1786 - grid.cpp:634-636 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 1792 - grid.cpp:818-870 - libgromacs_mpi.so.9.0.0 [...] | 0.01 | 0.00 | 0.02 | 0.01 | 0.00 | 0.00 | 15 | 0.01 | 0.00 | |||
| ○Loop 1793 - grid.cpp:825-836 - libgromacs_mpi.so.9.0.0 | 0.01 | 0.01 | 0.01 | 0.01 | 0.00 | 0.00 | 43 | 0.02 | 0.00 | |||
| ○Loop 1787 - grid.cpp:477-484 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 1784 - grid.cpp:599-606 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 1789 - grid.cpp:923-925 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 1785 - grid.cpp:634-636 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 1788 - grid.cpp:532-539 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 8 | 0.00 | 0.00 | |||
| ○Loop 1790 - grid.cpp:923-925 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.01 | 0.01 | 0.00 | 0.00 | 5 | 0.00 | 0.00 | |||
| ○Loop 1783 - grid.cpp:505-512 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 1791 - grid.cpp:913-917 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○__atan2f_finite | libm.so.6 | 0.02 | 0.02 | 0.03 | 0.03 | 0.00 | 0.00 | 65 | 0.03 | 0.00 | Math (%): 100.00 | |
| ○DftiComputeBackward | libmkl_intel_lp64.so.2 | 0.02 | 0.02 | 0.02 | 0.02 | 0.00 | 0.00 | 55 | 0.03 | 0.01 | Math (%): 100.00 | |
| ○mkl_dft_def_ippsFFTInv_CCSToR_32f | libmkl_def.so.2 | 0.02 | 0.02 | 0.04 | 0.04 | 0.00 | 0.00 | 53 | 0.04 | 0.01 | Math (%): 100.00 | |
| ►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*) | libgromacs_mpi.so.9.0.0 | 0.02 | 0.00 | 0.01 | 0.01 | 0.00 | 0.00 | 105 | 0.00 | 0.00 | /home/eoseret/gromacs-2024.2/install_MPI/lib64/libgromacs_mpi.so.9.0.0 (%): 100.00 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 --driver-mode=g++ -D GMX_DOUBLE=0 -D HAVE_CONFIG_H -D TMPI_EXPORTS -D TMPI_USE_VISIBILITY -D USE_STD_INTTYPES_H -D libgromacs_EXPORTS -I /home/eoseret/g... |
| ○Loop 14351 - constraintrange.cpp:79-152 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 5 | 0.00 | 0.00 | |||
| ►Loop 14353 - constraintrange.cpp:79-152 - libgromacs_mpi.so.9.0.0 [...] | 0.01 | 0.01 | 0.02 | 0.01 | 0.00 | 0.00 | 69 | 0.00 | 0.00 | |||
| ○Loop 14354 - constraintrange.cpp:124-128 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 14355 - constraintrange.cpp:83-85 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.01 | 0.01 | 0.00 | 0.00 | 5 | 0.00 | 0.00 | |||
| ○Loop 14352 - constraintrange.cpp:83-85 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 14356 - constraintrange.cpp:83-85 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 1 | 0.00 | 0.00 | |||
| ►.omp_outlined..73 | libgromacs_mpi.so.9.0.0 | 0.02 | 0.00 | 0.02 | 0.00 | 0.00 | 0.00 | 70 | 0.02 | 0.00 | /home/eoseret/gromacs-2024.2/install_MPI/lib64/libgromacs_mpi.so.9.0.0 (%): 100.00 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 --driver-mode=g++ -D GMX_DOUBLE=0 -D HAVE_CONFIG_H -D TMPI_EXPORTS -D TMPI_USE_VISIBILITY -D USE_STD_INTTYPES_H -D libgromacs_EXPORTS -I /home/eoseret/g... |
| ○Loop 15303 - sim_util.cpp:151-151 - libgromacs_mpi.so.9.0.0 [...] | 0.02 | 0.02 | 0.02 | 0.02 | 0.00 | 0.00 | 70 | 0.02 | 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 | 0.00 | 0.02 | 0.00 | 0.00 | 0.00 | 53 | 0.03 | 0.01 | /home/eoseret/gromacs-2024.2/install_MPI/lib64/libgromacs_mpi.so.9.0.0 (%): 100.00 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 --driver-mode=g++ -D GMX_DOUBLE=0 -D HAVE_CONFIG_H -D TMPI_EXPORTS -D TMPI_USE_VISIBILITY -D USE_STD_INTTYPES_H -D libgromacs_EXPORTS -I /home/eoseret/g... |
| ►Loop 17390 - pme_only.cpp:178-860 - libgromacs_mpi.so.9.0.0 [...] | 0.02 | 0.00 | 0.05 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17399 - pme_only.cpp:354-354 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17398 - alloc_traits.h:261-261 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17400 - pme_only.cpp:354-354 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17404 - alloc_traits.h:261-261 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17406 - alloc_traits.h:261-261 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17395 - alloc_traits.h:261-261 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17402 - stl_uninitialized.h:1031-1031 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17397 - alloc_traits.h:261-261 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17394 - alloc_traits.h:261-261 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17403 - alloc_traits.h:261-261 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17391 - stl_uninitialized.h:1031-1031 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 17389 - pme_only.cpp:178-860 - libgromacs_mpi.so.9.0.0 [...] | 0.02 | 0.00 | 0.05 | 0.00 | 0.00 | 0.00 | 4 | 0.00 | 0.00 | |||
| ►Loop 17386 - pme_only.cpp:178-860 - libgromacs_mpi.so.9.0.0 [...] | 0.01 | 0.01 | 0.04 | 0.01 | 0.00 | 0.00 | 35 | 0.02 | 0.00 | |||
| ►Loop 17387 - pme_only.cpp:178-758 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.01 | 0.00 | 0.00 | 0.00 | 4 | 0.00 | 0.00 | |||
| ○Loop 17388 - pme_only.cpp:197-200 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17384 - pme_only.cpp:279-518 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.01 | 0.01 | 0.00 | 0.00 | 6 | 0.00 | 0.00 | |||
| ○Loop 17409 - pme_only.cpp:588-609 - libgromacs_mpi.so.9.0.0 [...] | 0.01 | 0.01 | 0.01 | 0.01 | 0.00 | 0.00 | 25 | 0.02 | 0.00 | |||
| ○Loop 17410 - pme_only.cpp:468-509 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 6 | 0.00 | 0.00 | |||
| ○Loop 17392 - stl_uninitialized.h:1031-1031 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17407 - alloc_traits.h:261-261 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17396 - stl_uninitialized.h:1031-1031 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17405 - stl_uninitialized.h:1031-1031 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17393 - stl_uninitialized.h:1031-1031 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17401 - pme_only.cpp:352-359 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17408 - pme_only.cpp:331-345 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17385 - pme_only.cpp:870-873 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 17412 - pme_only.cpp:151-153 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17414 - new_allocator.h:162-162 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17413 - stl_uninitialized.h:1031-1031 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17411 - pme_only.cpp:408-424 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○MPIR_Waitall | libmpi.so.12.0.0 | 0.02 | 0.02 | 0.02 | 0.02 | 0.00 | 0.00 | 47 | 0.03 | 0.01 | MPI (%): 100.00 | |
| ○MPIR_Sendrecv_replace_impl | libmpi.so.12.0.0 | 0.02 | 0.02 | 0.01 | 0.01 | 0.00 | 0.00 | 74 | 0.02 | 0.00 | MPI (%): 100.00 | |
| ○DftiComputeForward | libmkl_intel_lp64.so.2 | 0.02 | 0.02 | 0.03 | 0.03 | 0.00 | 0.00 | 44 | 0.04 | 0.01 | Math (%): 100.00 | |
| ►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 | 0.00 | 0.02 | 0.00 | 0.00 | 0.00 | 64 | 0.02 | 0.00 | /home/eoseret/gromacs-2024.2/install_MPI/lib64/libgromacs_mpi.so.9.0.0 (%): 100.00 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 --driver-mode=g++ -D GMX_DOUBLE=0 -D HAVE_CONFIG_H -D TMPI_EXPORTS -D TMPI_USE_VISIBILITY -D USE_STD_INTTYPES_H -D libgromacs_EXPORTS -I /home/eoseret/g... |
| ○Loop 14261 - calcvir.cpp:61-67 - libgromacs_mpi.so.9.0.0 [...] | 0.02 | 0.02 | 0.02 | 0.02 | 0.00 | 0.00 | 64 | 0.02 | 0.00 | |||
| ○Loop 14262 - calcvir.cpp:61-81 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►gmx::ThreadForceBuffer<float [4]>::clearForcesAndEnergies() | libgromacs_mpi.so.9.0.0 | 0.02 | 0.00 | 0.02 | 0.00 | 0.00 | 0.00 | 57 | 0.03 | 0.01 | /home/eoseret/gromacs-2024.2/install_MPI/lib64/libgromacs_mpi.so.9.0.0 (%): 100.00 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 --driver-mode=g++ -D GMX_DOUBLE=0 -D HAVE_CONFIG_H -D TMPI_EXPORTS -D TMPI_USE_VISIBILITY -D USE_STD_INTTYPES_H -D libgromacs_EXPORTS -I /home/eoseret/g... |
| ○Loop 4234 - threaded_force_buffer.cpp:78-78 - libgromacs_mpi.so.9.0.0 [...] | 0.01 | 0.01 | 0.02 | 0.02 | 0.00 | 0.00 | 53 | 0.03 | 0.00 | |||
| ○__kmp_join_call | libomp.so | 0.02 | 0.02 | 0.01 | 0.01 | 0.00 | 0.00 | 66 | 0.02 | 0.00 | OMP (%): 100.00 | |
| ○MPIC_Isend | libmpi.so.12.0.0 | 0.01 | 0.01 | 0.02 | 0.02 | 0.00 | 0.00 | 49 | 0.03 | 0.00 | MPI (%): 100.00 | |
| ○__GI___libc_malloc | libc.so.6 | 0.01 | 0.01 | 0.02 | 0.02 | 0.00 | 0.00 | 67 | 0.02 | 0.00 | Memory (%): 100.00 | |
| ○MPIDI_GPU_request_complete | libmpi.so.12.0.0 | 0.01 | 0.01 | 0.02 | 0.02 | 0.00 | 0.00 | 68 | 0.02 | 0.00 | MPI (%): 100.00 | |
| ○compute_1d_small_bwd | libmkl_def.so.2 | 0.01 | 0.01 | 0.03 | 0.03 | 0.00 | 0.00 | 48 | 0.03 | 0.01 | Math (%): 100.00 | |
| ○MPI_Sendrecv | libmpi.so.12.0.0 | 0.01 | 0.01 | 0.03 | 0.03 | 0.00 | 0.00 | 64 | 0.02 | 0.00 | MPI (%): 100.00 | |
| ►gmx::InMemoryDeserializer::doInt(int*) | libgromacs_mpi.so.9.0.0 | 0.01 | 0.01 | 0.01 | 0.01 | 0.00 | 0.00 | 84 | 0.00 | 0.00 | /home/eoseret/gromacs-2024.2/install_MPI/lib64/libgromacs_mpi.so.9.0.0 (%): 100.00 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 --driver-mode=g++ -D GMX_DOUBLE=0 -D HAVE_CONFIG_H -D TMPI_EXPORTS -D TMPI_USE_VISIBILITY -D USE_STD_INTTYPES_H -D libgromacs_EXPORTS -I /home/eoseret/g... |
| ○Loop 131 - inmemoryserializer.cpp:92-92 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.01 | 0.01 | 0.00 | 0.00 | 9 | 0.00 | 0.00 | |||
| ○MPIR_Request_completion_processing | libmpi.so.12.0.0 | 0.01 | 0.01 | 0.03 | 0.03 | 0.00 | 0.00 | 61 | 0.02 | 0.00 | MPI (%): 100.00 | |
| ○MPIDU_Init_shm_barrier | libmpi.so.12.0.0 | 0.01 | 0.01 | 0.03 | 0.03 | 0.00 | 0.00 | 62 | 0.03 | 0.00 | MPI (%): 100.00 | |
| ○mpi_combiner_2_hcoll_combiner | libmpi.so.12.0.0 | 0.01 | 0.01 | 0.02 | 0.02 | 0.00 | 0.00 | 48 | 0.03 | 0.00 | MPI (%): 100.00 | |
| ○compute_1d_small_bwd | libmkl_def.so.2 | 0.01 | 0.01 | 0.02 | 0.02 | 0.00 | 0.00 | 44 | 0.03 | 0.00 | Math (%): 100.00 | |
| ○MPI_Irecv | libmpi.so.12.0.0 | 0.01 | 0.01 | 0.01 | 0.01 | 0.00 | 0.00 | 54 | 0.02 | 0.00 | MPI (%): 100.00 | |
| ►.omp_outlined.#0x69eab0 | libgromacs_mpi.so.9.0.0 | 0.01 | 0.00 | 0.02 | 0.00 | 0.00 | 0.00 | 53 | 0.02 | 0.00 | /home/eoseret/gromacs-2024.2/install_MPI/lib64/libgromacs_mpi.so.9.0.0 (%): 100.00 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 --driver-mode=g++ -D GMX_DOUBLE=0 -D HAVE_CONFIG_H -D TMPI_EXPORTS -D TMPI_USE_VISIBILITY -D USE_STD_INTTYPES_H -D libgromacs_EXPORTS -I /home/eoseret/g... |
| ►Loop 1566 - domdec_constraints.cpp:206-457 - libgromacs_mpi.so.9.0.0 [...] | 0.01 | 0.00 | 0.04 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 1567 - domdec_constraints.cpp:206-252 - libgromacs_mpi.so.9.0.0 [...] | 0.01 | 0.00 | 0.04 | 0.01 | 0.00 | 0.00 | 28 | 0.01 | 0.00 | |||
| ○Loop 1574 - domdec_constraints.cpp:226-229 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 1573 - domdec_constraints.cpp:226-229 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 1569 - ga2la.h:112-126 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.01 | 0.00 | 0.00 | 0.00 | 5 | 0.00 | 0.00 | |||
| ○Loop 1570 - hashedmap.h:277-282 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 5 | 0.00 | 0.00 | |||
| ○Loop 1575 - domdec_constraints.cpp:226-229 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 1568 - mtop_lookup.h:93-106 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 2 | 0.00 | 0.00 | |||
| ►Loop 1571 - hashedmap.h:274-282 - libgromacs_mpi.so.9.0.0 [...] | 0.01 | 0.00 | 0.01 | 0.01 | 0.00 | 0.00 | 15 | 0.01 | 0.00 | |||
| ○Loop 1572 - hashedmap.h:277-282 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.01 | 0.01 | 0.00 | 0.00 | 15 | 0.00 | 0.00 | |||
| ○Loop 1576 - domdec_constraints.cpp:226-229 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 1577 - domdec_constraints.cpp:226-236 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►.omp_outlined..3#0xc01c30 | libgromacs_mpi.so.9.0.0 | 0.01 | 0.00 | 0.02 | 0.00 | 0.00 | 0.00 | 41 | 0.03 | 0.00 | /home/eoseret/gromacs-2024.2/install_MPI/lib64/libgromacs_mpi.so.9.0.0 (%): 100.00 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 --driver-mode=g++ -D GMX_DOUBLE=0 -D HAVE_CONFIG_H -D TMPI_EXPORTS -D TMPI_USE_VISIBILITY -D USE_STD_INTTYPES_H -D libgromacs_EXPORTS -I /home/eoseret/g... |
| ►Loop 14248 - pme_grid.cpp:529-539 - libgromacs_mpi.so.9.0.0 | 0.01 | 0.00 | 0.02 | 0.00 | 0.00 | 0.00 | 4 | 0.00 | 0.00 | |||
| ►Loop 14249 - pme_grid.cpp:535-539 - libgromacs_mpi.so.9.0.0 | 0.01 | 0.00 | 0.02 | 0.00 | 0.00 | 0.00 | 17 | 0.00 | 0.00 | |||
| ○Loop 14252 - pme_grid.cpp:537-539 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 14250 - pme_grid.cpp:537-539 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 14251 - pme_grid.cpp:537-539 - libgromacs_mpi.so.9.0.0 | 0.01 | 0.01 | 0.01 | 0.01 | 0.00 | 0.00 | 29 | 0.02 | 0.00 | |||
| ○Loop 14253 - pme_grid.cpp:537-539 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 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 | 57 | 0.02 | 0.00 | System (%): 98.59 Math (%): 1.41 | |
| ○mkl_dft_def_ippsFFTFwd_RToPerm_32f | libmkl_def.so.2 | 0.01 | 0.01 | 0.01 | 0.01 | 0.00 | 0.00 | 40 | 0.03 | 0.00 | Math (%): 100.00 | |
| ►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 | 0.01 | 0.00 | 0.02 | 0.01 | 0.00 | 0.00 | 47 | 0.02 | 0.00 | /home/eoseret/gromacs-2024.2/install_MPI/lib64/libgromacs_mpi.so.9.0.0 (%): 100.00 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 --driver-mode=g++ -D GMX_DOUBLE=0 -D HAVE_CONFIG_H -D TMPI_EXPORTS -D TMPI_USE_VISIBILITY -D USE_STD_INTTYPES_H -D libgromacs_EXPORTS -I /home/eoseret/g... |
| ○Loop 3143 - hashedmap.h:167-167 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 3140 - ga2la.h:112-126 - libgromacs_mpi.so.9.0.0 [...] | 0.01 | 0.01 | 0.02 | 0.01 | 0.00 | 0.00 | 28 | 0.02 | 0.00 | |||
| ○Loop 3141 - hashedmap.h:277-282 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.01 | 0.01 | 0.00 | 0.00 | 7 | 0.01 | 0.00 | |||
| ○Loop 3146 - hashedmap.h:277-282 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 3 | 0.00 | 0.00 | |||
| ○Loop 3145 - hashedmap.h:277-282 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 1 | 0.00 | 0.00 | |||
| ○Loop 3144 - hashedmap.h:187-189 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 3142 - hashedmap.h:277-282 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 4 | 0.00 | 0.00 | |||
| ○MPI_Recv | libmpi.so.12.0.0 | 0.01 | 0.01 | 0.01 | 0.01 | 0.00 | 0.00 | 58 | 0.01 | 0.00 | MPI (%): 100.00 | |
| ○compute_1d_small_fwd | libmkl_def.so.2 | 0.01 | 0.01 | 0.02 | 0.02 | 0.00 | 0.00 | 40 | 0.03 | 0.00 | Math (%): 100.00 | |
| ►make_dd_indices(gmx_domdec_t*, int) | libgromacs_mpi.so.9.0.0 | 0.01 | 0.00 | 0.02 | 0.00 | 0.00 | 0.00 | 51 | 0.02 | 0.00 | /home/eoseret/gromacs-2024.2/install_MPI/lib64/libgromacs_mpi.so.9.0.0 (%): 100.00 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 --driver-mode=g++ -D GMX_DOUBLE=0 -D HAVE_CONFIG_H -D TMPI_EXPORTS -D TMPI_USE_VISIBILITY -D USE_STD_INTTYPES_H -D libgromacs_EXPORTS -I /home/eoseret/g... |
| ►Loop 3568 - partition.cpp:515-540 - libgromacs_mpi.so.9.0.0 [...] | 0.01 | 0.00 | 0.03 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 3569 - partition.cpp:529-540 - libgromacs_mpi.so.9.0.0 [...] | 0.01 | 0.01 | 0.03 | 0.01 | 0.00 | 0.00 | 38 | 0.02 | 0.00 | |||
| ○Loop 3572 - hashedmap.h:187-189 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 3 | 0.00 | 0.00 | |||
| ○Loop 3570 - hashedmap.h:167-167 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.01 | 0.01 | 0.00 | 0.00 | 13 | 0.01 | 0.00 | |||
| ○Loop 3571 - stl_uninitialized.h:1031-1031 - libgromacs_mpi.so.9.0.0 [...] | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►wrap_periodic_pmegrid(gmx_pme_t const*, float*) | libgromacs_mpi.so.9.0.0 | 0.01 | 0.00 | 0.02 | 0.01 | 0.00 | 0.00 | 43 | 0.02 | 0.00 | /home/eoseret/gromacs-2024.2/install_MPI/lib64/libgromacs_mpi.so.9.0.0 (%): 100.00 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 --driver-mode=g++ -D GMX_DOUBLE=0 -D HAVE_CONFIG_H -D TMPI_EXPORTS -D TMPI_USE_VISIBILITY -D USE_STD_INTTYPES_H -D libgromacs_EXPORTS -I /home/eoseret/g... |
| ►Loop 17311 - pme_grid.cpp:465-471 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 17312 - pme_grid.cpp:467-471 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17313 - pme_grid.cpp:469-471 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17315 - pme_grid.cpp:469-471 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17314 - pme_grid.cpp:469-471 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17310 - pme_grid.cpp:469-471 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 17317 - pme_grid.cpp:449-455 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 17318 - pme_grid.cpp:451-455 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17321 - pme_grid.cpp:453-455 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17319 - pme_grid.cpp:453-455 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17320 - pme_grid.cpp:453-455 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17316 - pme_grid.cpp:453-455 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ►Loop 17322 - pme_grid.cpp:436-442 - libgromacs_mpi.so.9.0.0 | 0.01 | 0.00 | 0.02 | 0.01 | 0.00 | 0.00 | 4 | 0.00 | 0.00 | |||
| ►Loop 17323 - pme_grid.cpp:438-442 - libgromacs_mpi.so.9.0.0 | 0.01 | 0.00 | 0.02 | 0.01 | 0.00 | 0.00 | 13 | 0.00 | 0.00 | |||
| ○Loop 17326 - pme_grid.cpp:440-442 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17324 - pme_grid.cpp:440-442 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 0.00 | 0.00 | |||
| ○Loop 17325 - pme_grid.cpp:440-442 - libgromacs_mpi.so.9.0.0 | 0.01 | 0.01 | 0.01 | 0.01 | 0.00 | 0.00 | 33 | 0.01 | 0.00 | |||
| ○Loop 17327 - pme_grid.cpp:440-442 - libgromacs_mpi.so.9.0.0 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 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 | 52 | 0.02 | 0.00 | MPI (%): 100.00 | |
| ○mkl_dft_def_ippsDFTInv_CToC_32fc | libmkl_def.so.2 | 0.01 | 0.01 | 0.03 | 0.03 | 0.00 | 0.00 | 36 | 0.03 | 0.01 | Math (%): 100.00 | |
| ►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 | 0.00 | 0.01 | 0.00 | 0.00 | 0.00 | 49 | 0.02 | 0.00 | /home/eoseret/gromacs-2024.2/install_MPI/lib64/libgromacs_mpi.so.9.0.0 (%): 100.00 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 --driver-mode=g++ -D GMX_DOUBLE=0 -D HAVE_CONFIG_H -D TMPI_EXPORTS -D TMPI_USE_VISIBILITY -D USE_STD_INTTYPES_H -D libgromacs_EXPORTS -I /home/eoseret/g... |
| ►Loop 1794 - grid.cpp:1048-1095 - libgromacs_mpi.so.9.0.0 [...] | 0.01 | 0.00 | 0.02 | 0.01 | 0.00 | 0.00 | 8 | 0.00 | 0.00 | |||
| ○Loop 1795 - grid.cpp:1070-1089 - libgromacs_mpi.so.9.0.0 [...] | 0.01 | 0.01 | 0.01 | 0.01 | 0.00 | 0.00 | 43 | 0.02 | 0.00 | |||
| ○MPIDU_Init_shm_init | libmpi.so.12.0.0 | 0.01 | 0.01 | 0.01 | 0.01 | 0.00 | 0.00 | 54 | 0.01 | 0.00 | MPI (%): 100.00 | |
| ○MPIU_Selection_find_entry | libmpi.so.12.0.0 | 0.01 | 0.01 | 0.01 | 0.01 | 0.00 | 0.00 | 50 | 0.01 | 0.00 | MPI (%): 100.00 | |
| ►globalAtomIndexToMoltypeIndices(gmx::ArrayRef<MolblockIndices const>, int) | libgromacs_mpi.so.9.0.0 | 0.01 | 0.00 | 0.02 | 0.01 | 0.00 | 0.00 | 48 | 0.02 | 0.00 | /home/eoseret/gromacs-2024.2/install_MPI/lib64/libgromacs_mpi.so.9.0.0 (%): 100.00 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 --driver-mode=g++ -D GMX_DOUBLE=0 -D HAVE_CONFIG_H -D TMPI_EXPORTS -D TMPI_USE_VISIBILITY -D USE_STD_INTTYPES_H -D libgromacs_EXPORTS -I /home/eoseret/g... |
| ○Loop 3618 - reversetopology.cpp:141-146 - libgromacs_mpi.so.9.0.0 | 0.01 | 0.01 | 0.01 | 0.01 | 0.00 | 0.00 | 28 | 0.01 | 0.00 |