* Info: Selecting the 'perf-low-ppn' engine for node inti6202
* Info: "ref-cycles" not supported on inti6202: fallback to "cpu-clock"
* Info: Process launched (host inti6202, process 2098158) :-) GROMACS - gmx mdrun, 2023.1 (-:
Executable: /ccc/work/cont001/ocre/oserete/gromacs-2023.1-install-icc-2/bin/gmx
Data prefix: /ccc/work/cont001/ocre/oserete/gromacs-2023.1-install-icc-2
Working dir: /ccc/work/cont001/ocre/oserete/GROMACS_DATA
Command line:
gmx mdrun -s ion_channel.tpr -ntmpi 1 -nsteps 10000 -pin on -deffnm icc-2
Back Off! I just backed up icc-2.log to ./#icc-2.log.11#
Reading file ion_channel.tpr, VERSION 2020.3 (single precision)
Note: file tpx version 119, software tpx version 129
Overriding nsteps with value passed on the command line: 10000 steps, 25 ps
Changing nstlist from 10 to 50, rlist from 1 to 1.095
Update groups can not be used for this system because there are three or more consecutively coupled constraints
Using 1 MPI thread
Using 128 OpenMP threads
Back Off! I just backed up icc-2.edr to ./#icc-2.edr.11#
starting mdrun 'Protein'
10000 steps, 25.0 ps.
Writing final coordinates.
Back Off! I just backed up icc-2.gro to ./#icc-2.gro.4#
Core t (s) Wall t (s) (%)
Time: 8280.014 64.689 12799.8
(ns/day) (hour/ns)
Performance: 33.394 0.719
GROMACS reminds you: "Mathematics is a game played according to certain rules with meaningless marks on paper." (David Hilbert)
* Info: Process finished (host inti6202, process 2098158)
* Warning: Collected empty callchains for 40.6% of 1st-event samples
* Info: Callchains info will be incomplete
* Info: Try to recompile your application with -fno-omit-frame-pointer or to rerun with btm=stack
* Info: Dumping samples (host inti6202, process 2098158)
* Info: Dumping source info for callchain nodes (host inti6202, process 2098158)
* Info: Building/writing metadata (host inti6202)
* Info: Finished collect step (host inti6202, process 2098158)
Your experiment path is /ccc/work/cont001/ocre/oserete/GROMACS_DATA/OV3_icc_128T/tools/lprof_npsu_run_0
To display your profiling results:
###########################################################################################################################################
# LEVEL | REPORT | COMMAND #
###########################################################################################################################################
# Functions | Cluster-wide | maqao lprof -df xp=/ccc/work/cont001/ocre/oserete/GROMACS_DATA/OV3_icc_128T/tools/lprof_npsu_run_0 #
# Functions | Per-node | maqao lprof -df -dn xp=/ccc/work/cont001/ocre/oserete/GROMACS_DATA/OV3_icc_128T/tools/lprof_npsu_run_0 #
# Functions | Per-process | maqao lprof -df -dp xp=/ccc/work/cont001/ocre/oserete/GROMACS_DATA/OV3_icc_128T/tools/lprof_npsu_run_0 #
# Functions | Per-thread | maqao lprof -df -dt xp=/ccc/work/cont001/ocre/oserete/GROMACS_DATA/OV3_icc_128T/tools/lprof_npsu_run_0 #
# Loops | Cluster-wide | maqao lprof -dl xp=/ccc/work/cont001/ocre/oserete/GROMACS_DATA/OV3_icc_128T/tools/lprof_npsu_run_0 #
# Loops | Per-node | maqao lprof -dl -dn xp=/ccc/work/cont001/ocre/oserete/GROMACS_DATA/OV3_icc_128T/tools/lprof_npsu_run_0 #
# Loops | Per-process | maqao lprof -dl -dp xp=/ccc/work/cont001/ocre/oserete/GROMACS_DATA/OV3_icc_128T/tools/lprof_npsu_run_0 #
# Loops | Per-thread | maqao lprof -dl -dt xp=/ccc/work/cont001/ocre/oserete/GROMACS_DATA/OV3_icc_128T/tools/lprof_npsu_run_0 #
###########################################################################################################################################
