schrodinger.application.desmond.fep_edge_data_classifier module

class schrodinger.application.desmond.fep_edge_data_classifier.Rating(value)

Bases: enum.Enum

An enumeration.

NA = 0
GOOD = 1
FAIR = 2
BAD = 3
schrodinger.application.desmond.fep_edge_data_classifier.rate(name: str, data) schrodinger.application.desmond.fep_edge_data_classifier.Rating

Return rating for the FEP edge data with the given name. The format of data varies depending on the case.


name – Name of the classifier. The allowed names are defined above.