schrodinger.infra.ligand_parameters module

schrodinger.infra.ligand_parameters.setting_ligand_parameters(**kwargs)

Set the ligand ASL parameters to the given values for the duration of the context.

For each argument, if None or not specified, do not change the corresponding setting.

Accepted parameters all those listed in LIGAND_ASL_PARAM_ATTRS, which are at the time of writing all of the LigandParameters object.