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Searched refs:PDB_TFACTOR (Results 1 – 1 of 1) sorted by relevance

/dports/science/rdkit/rdkit-Release_2021_03_5/Code/GraphMol/FileParsers/
H A DMaeMolSupplier.cpp41 const std::string PDB_TFACTOR = "r_m_pdb_tfactor"; variable
77 m_tempfac = atom_block.getRealProperty(PDB_TFACTOR); in PDBInfo()
259 } else if (prop.first == PDB_OCCUPANCY || prop.first == PDB_TFACTOR) { in set_atom_properties()