OESetCIPStereoΒΆ

bool OESetCIPStereo(OEMolBase &mol, OEAtomBase* atom, unsigned int cipstereo);

Sets the internal OEChem stereochemistry from the given CIP atom stereo descriptor. The descriptor must be either OECIPAtomStereo.R or OECIPAtomStereo.S. This function returns true if the stereochemistry was successfully set, and false otherwise: i.e. the descriptor was invalid or the specified atom was not a CIP atom stereo center.

See also

bool OESetCIPStereo(OEMolBase &mol, OEBondBase* bond, unsigned int cipstereo);

Sets the internal OEChem stereochemistry from the given CIP atom stereo descriptor. The descriptor must be either OECIPBondStereo.E or OECIPBondStereo.Z. This function returns true if the stereochemistry was successfully set, and false otherwise: i.e. the descriptor was invalid or the specified bond was not a CIP bond stereo center.

See also