BespokeFit documentation

openff-bespokefit

openff.bespokefit.executor.BespokeWorkerConfig

model openff.bespokefit.executor.BespokeWorkerConfig

Bases: BaseModel

Configuration options for a bespoke executor worker.

Fields

• max_memory (Union[float, Literal['auto']])

• n_cores (Union[int, Literal['auto']])

field n_cores: Union[int, Literal['auto']] = 1

The maximum number of cores to reserve for this worker to parallelize tasks, such as QC chemical calculations, across.

field max_memory: Union[float, Literal['auto']] = 'auto'

A guideline for the total maximum memory in GB per core that is available for this worker. This number may be ignored depending on the task type.