Searched refs:MakeCombinedMolecule (Results 1 – 4 of 4) sorted by relevance
135 static OBMol* MakeCombinedMolecule(OBMol* pFirst, OBMol* pSecond);
260 OBMol* pNewMol = MakeCombinedMolecule(itr->second, pmol); in DeferMolOutput()314 OBMol* OBMoleculeFormat::MakeCombinedMolecule(OBMol* pFirst, OBMol* pSecond) in MakeCombinedMolecule() function in OpenBabel::OBMoleculeFormat
705 … obsharedptr<OBMol> psnewmol(OBMoleculeFormat::MakeCombinedMolecule(mapitr->second.get(),&thmol)); in ReadThermo()751 … obsharedptr<OBMol> psnewmol(OBMoleculeFormat::MakeCombinedMolecule(mapitr->second.get(),&thmol)); in ReadStdThermo()
671 …obsharedptr<OBMol> spnew(OBMoleculeFormat::MakeCombinedMolecule(mapitr->second.get(), spmol.get())… in AddMolToList()