OEScrambleMolecule

bool OEScrambleMolecule(OEMolBase &)

Randomly reorders the atoms and bonds of a molecule. Like OEMolBase::OrderAtoms and OEMolBase::OrderBonds, this function modifies the order in which atoms and bonds are visited by the iterator returned by OEMolBase::GetAtoms and OEMolBase::GetBonds respectively. This function does not affect the atom or bond indices of any of the atoms or bonds of the molecule.

See also

• Example program randomizeatoms.cpp