OECreateInChIKey

OECreateInChIKey(str: str, mol: Union[OEGraphMol,OEMol,OEQMol],
                 arg3: OEInChIOptions = OEInChIOptions()) -> None

Creates an InChIKey string representing a given molecule.

Note

The underlying InChI code is v1.06 released on December 15, 2020.