drugforge.data.schema.ligand

Functions

write_ligands_to_multi_sdf(sdf_name, ligands)

Dumb way to do this, but just write out each ligand to the same.

Classes

ChemicalRelationship(value)	Enum describing the chemical relationship between two ligands.
Ligand(*[, compound_name, ids, ...])	Schema for a Ligand.
ReferenceLigand(*[, compound_name, ids, ...])

Exceptions

InvalidLigandError