schrodinger.application.transforms.dockers.validation module

schrodinger.application.transforms.dockers.validation.get_validated_settings_kwargs(settings_class: type, settings: Optional[Any] = None, **kwargs) → Any

Return the validated instance of the settings, if not None, or the instance created from the settings_class with the kwargs.

Raises

ValueError – if the settings or kwargs are invalid

schrodinger.application.transforms.dockers.validation.validate_gridgen_params(params: dict)

Validate the grid parameters.

Raises

ValueError – if the grid parameters are invalid