OELigandFFType¶
This namespace contains constants that define force fields type appropriate for working with ligands.
MMFF94
The Merck Molecular Force Field (MMFF). Name: mmff94
MMFF94S
The 94s variation of the Merck Molecular Force Field (MMFF). Name: mmff94s
PARSLEY
The latest version (1.3.1) of the Parsley series of force field from the OPENFF consortium. Name: parsley
SAGE
The latest version (2.0.0) of the Sage series of force field from the OPENFF consortium. Name: sage