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r0r1r2
external_libraries{ 1 = /ccc/work/cont001/ocre/oserete/gromacs-2022.4-install-gcc-ompi/lib64/libgromacs_mpi.so.7 ; },
{ 1 = /ccc/work/cont001/ocre/oserete/gromacs-2022.4-install-icc-ompi/lib64/libgromacs_mpi.so.7 ; },
{ 1 = /ccc/work/cont001/ocre/oserete/gromacs-2022.4-install-icx-ompi/lib64/libgromacs_mpi.so.7 ; },
number_processes111
number_nodes111
number_processes_per_node111
mpi_commandccc_mprun -p milan-bxi -T 1200 -n <number_processes> -x -E --enable_perf -c <OMP_NUM_THREADS>ccc_mprun -p milan-bxi -T 1200 -n <number_processes> -x -E --enable_perf -c <OMP_NUM_THREADS>ccc_mprun -p milan-bxi -T 1200 -n <number_processes> -x -E --enable_perf -c <OMP_NUM_THREADS>
run_command<executable> mdrun -s ion_channel.tpr -nsteps 2000 -pin on -deffnm gcc<executable> mdrun -s ion_channel.tpr -nsteps 2000 -pin on -deffnm icc<executable> mdrun -s ion_channel.tpr -nsteps 2000 -pin on -deffnm icx
batch_script
batch_command
pinning_command
custom_categories{ { type = library ; value = libgromacs_mpi.so.7 ; },
},
{ { type = library ; value = libgromacs_mpi.so.7 ; },
},
{ { type = library ; value = libgromacs_mpi.so.7 ; },
},
dataset
dataset_handlerlinklinklink
run_directory...
frequencies{ 1 = 0 ; },
{ 1 = 0 ; },
{ 1 = 0 ; },
filter{ type = number ; value = 1 ; },
{ type = number ; value = 1 ; },
{ type = number ; value = 1 ; },
profile_start{ unit = none ; value = 0 ; },
{ unit = none ; value = 0 ; },
{ unit = none ; value = 0 ; },
additional_hwc{ },
{ },
{ },
excluded_areas{ },
{ },
{ },
decan_multi_varianttruetruetrue
decan_all_variantstruetruetrue
maximal_path_number444
included_areas{ },
{ },
{ },
is_sudo_availablefalsefalsefalse
keep_executable_locationtruetruetrue
lprof_params
lprof_post_process_params{ },
{ },
{ },
vprof_params
decan_params
cqa_params{ },
{ },
{ },
multiruns_params{ { binary = /ccc/work/cont001/ocre/oserete/gromacs-2022.4-install-gcc-ompi/bin/gmx_mpi ; name = 1x2 ; environment_variables = { { name = OMP_NUM_THREADS ; value = 2 ; },
},
},
{ binary = /ccc/work/cont001/ocre/oserete/gromacs-2022.4-install-gcc-ompi/bin/gmx_mpi ; name = 1x4 ; environment_variables = { { name = OMP_NUM_THREADS ; value = 4 ; },
},
},
{ binary = /ccc/work/cont001/ocre/oserete/gromacs-2022.4-install-gcc-ompi/bin/gmx_mpi ; name = 1x8 ; environment_variables = { { name = OMP_NUM_THREADS ; value = 8 ; },
},
},
{ binary = /ccc/work/cont001/ocre/oserete/gromacs-2022.4-install-gcc-ompi/bin/gmx_mpi ; name = 1x16 ; environment_variables = { { name = OMP_NUM_THREADS ; value = 16 ; },
},
},
{ binary = /ccc/work/cont001/ocre/oserete/gromacs-2022.4-install-gcc-ompi/bin/gmx_mpi ; name = 1x32 ; environment_variables = { { name = OMP_NUM_THREADS ; value = 32 ; },
},
},
{ binary = /ccc/work/cont001/ocre/oserete/gromacs-2022.4-install-gcc-ompi/bin/gmx_mpi ; name = 1x64 ; environment_variables = { { name = OMP_NUM_THREADS ; value = 64 ; },
},
},
{ binary = /ccc/work/cont001/ocre/oserete/gromacs-2022.4-install-gcc-ompi/bin/gmx_mpi ; name = 1x128 ; environment_variables = { { name = OMP_NUM_THREADS ; value = 128 ; },
},
},
},
{ { binary = /ccc/work/cont001/ocre/oserete/gromacs-2022.4-install-icc-ompi/bin/gmx_mpi ; name = 1x2 ; environment_variables = { { name = OMP_NUM_THREADS ; value = 2 ; },
},
},
{ binary = /ccc/work/cont001/ocre/oserete/gromacs-2022.4-install-icc-ompi/bin/gmx_mpi ; name = 1x4 ; environment_variables = { { name = OMP_NUM_THREADS ; value = 4 ; },
},
},
{ binary = /ccc/work/cont001/ocre/oserete/gromacs-2022.4-install-icc-ompi/bin/gmx_mpi ; name = 1x8 ; environment_variables = { { name = OMP_NUM_THREADS ; value = 8 ; },
},
},
{ binary = /ccc/work/cont001/ocre/oserete/gromacs-2022.4-install-icc-ompi/bin/gmx_mpi ; name = 1x16 ; environment_variables = { { name = OMP_NUM_THREADS ; value = 16 ; },
},
},
{ binary = /ccc/work/cont001/ocre/oserete/gromacs-2022.4-install-icc-ompi/bin/gmx_mpi ; name = 1x32 ; environment_variables = { { name = OMP_NUM_THREADS ; value = 32 ; },
},
},
{ binary = /ccc/work/cont001/ocre/oserete/gromacs-2022.4-install-icc-ompi/bin/gmx_mpi ; name = 1x64 ; environment_variables = { { name = OMP_NUM_THREADS ; value = 64 ; },
},
},
{ binary = /ccc/work/cont001/ocre/oserete/gromacs-2022.4-install-icc-ompi/bin/gmx_mpi ; name = 1x128 ; environment_variables = { { name = OMP_NUM_THREADS ; value = 128 ; },
},
},
},
{ { binary = /ccc/work/cont001/ocre/oserete/gromacs-2022.4-install-icx-ompi/bin/gmx_mpi ; name = 1x2 ; environment_variables = { { name = OMP_NUM_THREADS ; value = 2 ; },
},
},
{ binary = /ccc/work/cont001/ocre/oserete/gromacs-2022.4-install-icx-ompi/bin/gmx_mpi ; name = 1x4 ; environment_variables = { { name = OMP_NUM_THREADS ; value = 4 ; },
},
},
{ binary = /ccc/work/cont001/ocre/oserete/gromacs-2022.4-install-icx-ompi/bin/gmx_mpi ; name = 1x8 ; environment_variables = { { name = OMP_NUM_THREADS ; value = 8 ; },
},
},
{ binary = /ccc/work/cont001/ocre/oserete/gromacs-2022.4-install-icx-ompi/bin/gmx_mpi ; name = 1x16 ; environment_variables = { { name = OMP_NUM_THREADS ; value = 16 ; },
},
},
{ binary = /ccc/work/cont001/ocre/oserete/gromacs-2022.4-install-icx-ompi/bin/gmx_mpi ; name = 1x32 ; environment_variables = { { name = OMP_NUM_THREADS ; value = 32 ; },
},
},
{ binary = /ccc/work/cont001/ocre/oserete/gromacs-2022.4-install-icx-ompi/bin/gmx_mpi ; name = 1x64 ; environment_variables = { { name = OMP_NUM_THREADS ; value = 64 ; },
},
},
{ binary = /ccc/work/cont001/ocre/oserete/gromacs-2022.4-install-icx-ompi/bin/gmx_mpi ; name = 1x128 ; environment_variables = { { name = OMP_NUM_THREADS ; value = 128 ; },
},
},
},
scalability_referencemainmainmain
environment_variables{ { name = OMP_NUM_THREADS ; value = 1 ; },
},
{ { name = OMP_NUM_THREADS ; value = 1 ; },
},
{ { name = OMP_NUM_THREADS ; value = 1 ; },
},
script_variables{ },
{ },
{ },
thread_filter_threshold2%2%2%
object_coverage_threshold0.010.010.01
_is_loadedOV1_GROMACS_ZEN3_gcc_OMP1/shared/run_0/config.luaOV1_GROMACS_ZEN3_icc_OMP1/shared/run_0/config.luaOV1_GROMACS_ZEN3_icx_OMP1/shared/run_0/config.lua
delay000
basebinarygmx_mpigmx_mpigmx_mpi
is_all_external_libraries_in_ccfalsefalsefalse
_scalability_bins{ },
{ },
{ },
ranges_count202020
#__scalability_referencetruetruetrue
repetitions313131
base_run_index0
__profile_starttruetruetrue
decan_threshold500500500
__maximal_path_numbertruetruetrue
outliers_count000
use_emonfalsefalsefalse
job_submission_threshold0s0s0s
__filtertruetruetrue
base_run_name1x11x11x1
bucket_threshold111
filter_decan{ type = all ; },
{ type = all ; },
{ type = all ; },
binary/ccc/work/cont001/ocre/oserete/gromacs-2022.4-install-gcc-ompi/bin/gmx_mpi/ccc/work/cont001/ocre/oserete/gromacs-2022.4-install-icc-ompi/bin/gmx_mpi/ccc/work/cont001/ocre/oserete/gromacs-2022.4-install-icx-ompi/bin/gmx_mpi
commentsGROMACS compiled with gcc 12.2.0 + OpenMPI, Zen 3, OV1, 2000 steps, single coreGROMACS compiled with icc 2021.8 + OpenMPI, Zen 3, OV1, 2000 steps, single coreGROMACS compiled with icx 2023.0.0 + OpenMPI, Zen 3, OV1, 2000 steps, single core
localbinary/ccc/work/cont001/ocre/oserete/gromacs-2022.4-install-gcc-ompi/bin/gmx_mpi/ccc/work/cont001/ocre/oserete/gromacs-2022.4-install-icc-ompi/bin/gmx_mpi/ccc/work/cont001/ocre/oserete/gromacs-2022.4-install-icx-ompi/bin/gmx_mpi
pinned_core
_is_custom_categoriestruetruetrue
hwc_reporting_cores111