schrodinger.application.bioluminate.residue_scanning.properties module

schrodinger.application.bioluminate.residue_scanning.properties.write_props_to_csv(sts: Structure, file_name: str) → None

Write the mutation property and all delta properties for each provided structure to CSV.

schrodinger.application.bioluminate.residue_scanning.properties.get_delta_property_values(st: Structure) → Dict[str, float]

Return a dictionary mapping Bioluminate delta structure properties to their values in the given structure.

Parameters:

st – The structure to inspect.