I'd like to edit scripts/hyperion to include something like:
if os.getenv("SLURM_SUBMIT_HOST") is None:
mpi_command = "mpiexec" # SLURM? No.
else:
mpi_command = "srun --mpi=pmix" # SLURM? Yes.
so that if the scheduling environment is SLURM, MPI will be run with srun instead of mpirun which is preferred (and, at least in our clusters case, required). I forked hyperion to do this and create a PR, but I can't figure out how to edit the code that goes to conda -- so more than an issue, this is a question as to how I can do that!
I'd like to edit
scripts/hyperionto include something like:so that if the scheduling environment is SLURM, MPI will be run with
sruninstead ofmpirunwhich is preferred (and, at least in our clusters case, required). I forkedhyperionto do this and create a PR, but I can't figure out how to edit the code that goes toconda-- so more than an issue, this is a question as to how I can do that!