Gromacs, Molecular Dynamics, Life Sciences, Google Cloud Platform, Bioinformatics.
/gromacs-2021.3/build/bin/gmx mdrun -nsteps 50000 -deffnm /benchMEM; tar cvzf $OUTPUT benchMEM.*’ \ --input INPUT=gs://<PROJECT_ID>-gromacs/benchMEM.tpr \ --output OUTPUT=gs://<PROJECT_ID>-gromacs/benchMEM.tar.gz \ --subnetwork default \ --preemptible \ --min-cores=8