File: run_full_mpi

package info (click to toggle)
gromacs 2025.4-1
  • links: PTS, VCS
  • area: main
  • in suites: forky, sid
  • size: 287,236 kB
  • sloc: xml: 3,718,478; cpp: 654,820; ansic: 75,282; python: 20,471; sh: 3,471; perl: 2,218; yacc: 644; fortran: 397; lisp: 265; makefile: 171; lex: 125; awk: 68; csh: 39
file content (8 lines) | stat: -rwxr-xr-x 275 bytes parent folder | download | duplicates (3) 
1
2
3
4
5
6
7
8
 
#!/usr/bin/env bash
# Entry point script for Docker containers.
# See README.md and the gmxapi/ci-<option> Docker images.

set -ev

mpiexec -n 2 `which python` -m mpi4py -m pytest $HOME/gmxapi/test
mpiexec -n 2 `which python` -m mpi4py -m pytest $HOME/sample_restraint/tests