options

Executable Output


* Info: Selecting the 'perf-low-ppn' engine for node ip-172-31-47-199

* Info: "ref-cycles" not supported on ip-172-31-47-199: fallback to "cpu-clock"
* Info: Process launched (host ip-172-31-47-199, process 21721)                      :-) GROMACS - gmx mdrun, 2022.4 (-:

Executable:   /home/eoseret/GROMACS/DATA/OV_dirs/OV1_G3E_armclang_SVE_OMP52_extlibs/binaries/gmx_mpi
Data prefix:  /usr/local/gromacs
Working dir:  /home/eoseret/GROMACS/DATA/GROMACS_TestCaseA
Command line:
  gmx_mpi mdrun -s ion_channel.tpr -nsteps 10000 -pin on -deffnm armclang


Back Off! I just backed up armclang.log to ./#armclang.log.10#
Reading file ion_channel.tpr, VERSION 2020.3 (single precision)
Note: file tpx version 119, software tpx version 127
Overriding nsteps with value passed on the command line: 10000 steps, 25 ps
Changing nstlist from 10 to 80, rlist from 1 to 1.129


Using 1 MPI process
Using 52 OpenMP threads 


Overriding thread affinity set outside gmx mdrun

Back Off! I just backed up armclang.edr to ./#armclang.edr.10#
starting mdrun 'Protein'
10000 steps,     25.0 ps.

Writing final coordinates.

Back Off! I just backed up armclang.gro to ./#armclang.gro.7#

               Core t (s)   Wall t (s)        (%)
       Time:     2434.695       46.821     5200.0
                 (ns/day)    (hour/ns)
Performance:       46.138        0.520

GROMACS reminds you: "Rat-tat-tat Ka boom boom" (The Smashing Pumpkins)


* Info: Process finished (host ip-172-31-47-199, process 21721)

Your experiment path is /home/eoseret/GROMACS/DATA/OV_dirs/OV1_G3E_armclang_SVE_OMP52_extlibs/tools/lprof_npsu_run_0

To display your profiling results:
########################################################################################################################################################
#    LEVEL    |     REPORT     |                                                        COMMAND                                                        #
########################################################################################################################################################
#  Functions  |  Cluster-wide  |  maqao lprof -df xp=/home/eoseret/GROMACS/DATA/OV_dirs/OV1_G3E_armclang_SVE_OMP52_extlibs/tools/lprof_npsu_run_0      #
#  Functions  |  Per-node      |  maqao lprof -df -dn xp=/home/eoseret/GROMACS/DATA/OV_dirs/OV1_G3E_armclang_SVE_OMP52_extlibs/tools/lprof_npsu_run_0  #
#  Functions  |  Per-process   |  maqao lprof -df -dp xp=/home/eoseret/GROMACS/DATA/OV_dirs/OV1_G3E_armclang_SVE_OMP52_extlibs/tools/lprof_npsu_run_0  #
#  Functions  |  Per-thread    |  maqao lprof -df -dt xp=/home/eoseret/GROMACS/DATA/OV_dirs/OV1_G3E_armclang_SVE_OMP52_extlibs/tools/lprof_npsu_run_0  #
#  Loops      |  Cluster-wide  |  maqao lprof -dl xp=/home/eoseret/GROMACS/DATA/OV_dirs/OV1_G3E_armclang_SVE_OMP52_extlibs/tools/lprof_npsu_run_0      #
#  Loops      |  Per-node      |  maqao lprof -dl -dn xp=/home/eoseret/GROMACS/DATA/OV_dirs/OV1_G3E_armclang_SVE_OMP52_extlibs/tools/lprof_npsu_run_0  #
#  Loops      |  Per-process   |  maqao lprof -dl -dp xp=/home/eoseret/GROMACS/DATA/OV_dirs/OV1_G3E_armclang_SVE_OMP52_extlibs/tools/lprof_npsu_run_0  #
#  Loops      |  Per-thread    |  maqao lprof -dl -dt xp=/home/eoseret/GROMACS/DATA/OV_dirs/OV1_G3E_armclang_SVE_OMP52_extlibs/tools/lprof_npsu_run_0  #
########################################################################################################################################################

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