#!/bin/bash run_gromacs_dir_name=$1 if [ -z "$run_gromacs_dir_name" ] then echo "run_gromacs_dir_name missing" echo "example : ./validate.sh run_01-13-20-17-10-24_compile_01-13-20-16-20-05" exit 1 fi cd $run_gromacs_dir_name perf=`grep Performance results | awk '{ print $2 }'` end_sim=`grep "Statistics over 1000001 steps using 100001 frames" large_ion_channel.log` mkdir results-gromacs-ion_channel_large cp large_ion_channel* results-gromacs-ion_channel_large/. cp slurm* results-gromacs-ion_channel_large/. cp results results-gromacs-ion_channel_large/. cd results-gromacs-ion_channel_large if [ -z "$perf" ] || [ -z "$end_sim" ] then echo "bench is not validated" else echo bench is validated echo end = $end_sim echo perf = $perf ns/day fi