drugforge.data.schema.identifiers

Classes

BespokeParameter(*[, type, values, units])	Store the bespoke parameters in a molecule.
BespokeParameters(*[, type, parameters])	A model to record the bespoke parameters for a ligand.
ChargeProvenance(*[, type])	A simple model to record the provenance of the local charging method.
LigandIdentifiers(*[, moonshot_compound_id, ...])	This is a schema for the identifiers associated with a ligand, optional identifiers are used as part of the ASAP workflow.
LigandProvenance(*, isomeric_smiles, inchi, ...)
TargetIdentifiers(*[, target_type, ...])	Identifiers for a Target