BespokeFit documentation

openff-bespokefit

openff.bespokefit.exceptions.MissingWorkflowError

exception openff.bespokefit.exceptions.MissingWorkflowError(message: str)

Bases: BespokeFitException

Raised when we try and complete a fitting entry that has no workflow set.

error_type = 'missing_workflow_error'

header = 'Missing Workflow Error'