OEGetHalideFraction
OEGetHalideFraction(mol: Union[OEGraphMol,OEMol,OEQMol],
isotopic: bool = False) -> float
Returns the percent of molecular weight from halides.
- isotopic
This parameter determines whether the isotopic information is taken into account when calculating the molecule weight.
See also
OECalculateMolecularWeightfunction in the OEChem TK manualHalide Fraction subsection describing filter files