Searched defs:newmol (Results 1 – 6 of 6) sorted by relevance
122 OBMol* newmol = static_cast<OBMol*>(newparent); in Clone() local
4086 …bool OBMol::CopySubstructure(OBMol& newmol, OBBitVec *atoms, OBBitVec *excludebonds, unsigned int … in CopySubstructure()4326 bool OBMol::GetNextFragment( OBMolAtomDFSIter& iter, OBMol& newmol ) { in GetNextFragment()
850 std::unique_ptr<RWMol> newmol; in molzip() local
918 Molecule *newmol = new Molecule(*this); in symmetrize() local
943 moleculeptr *newmolll,**newmol; in surfexpandmollist() local
45187 type (Molecule_Type) :: newmol local