Function ensureHeterotopicChiralBonds

  • ensureHeterotopicChiralBonds(molecule, options?): void

  • This function will add missing chiral bonds on carbons ensure that all enantiotopic or diastereotopic atoms can be identified uniquely

    Parameters

    • molecule: Molecule
    • Optional options: {
          atLeastThreeAtoms: undefined | boolean;
          esrType: undefined | number;
      } = {}
      • atLeastThreeAtoms: undefined | boolean

        if true, only carbons with at least three atoms will be considered

      • esrType: undefined | number

    Returns void

Settings

Member Visibility

Theme