schrodinger.application.desmond.msj_generator.subjob_msj module¶
- class schrodinger.application.desmond.msj_generator.subjob_msj.BaseMsjGenerator(jobname: str, cd_params: Dict[str, object], **kwargs)¶
Bases:
object
Base class.
- WorkflowParamsCls¶
alias of
schrodinger.application.desmond.msj_generator.workflow_params.WorkflowParams
- __init__(jobname: str, cd_params: Dict[str, object], **kwargs)¶
# TODO consider renaming
cpus
togpus
or more genericslots
:param jobname: The jobname.- Parameters
cd_params – A dictionary with
cpus
set to the number of gpu slots to use, and ‘mps_factor` set to the number of processes per GPU.