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Searched defs:reionized (Results 1 – 4 of 4) sorted by relevance

/dports/science/rdkit/rdkit-Release_2021_03_5/Code/GraphMol/MolStandardize/
H A DMolStandardize.cpp36 RWMol *reionized = MolStandardize::reionize(normalized.get(), params); in cleanup() local
121 ROMol *reionized = reionizer.reionize(m); in reionize() local
H A Dtest2.cpp154 ROMOL_SPTR reionized(reionizer.reionize(*m)); in testCharge() local
H A DtestPCS.cpp249 RWMOL_SPTR reionized(MolStandardize::reionize(m.get(), params)); in rdkitMolStandardizeReionize() local
H A DtestCharge.cpp33 ROMOL_SPTR reionized(reionizer.reionize(*m1)); in testReionizer() local