OEIsCIFHeaderCompliant

List[string] OEIsCIFHeaderCompliant(OEGraphMol mol, string cifDictionaryFilename)
List[string] OEIsCIFHeaderCompliant(OEMol mol, string cifDictionaryFilename)
List[string] OEIsCIFHeaderCompliant(OEQMol mol, string cifDictionaryFilename)

Checks if mmCIF header metadata stored on the molecule is compliant with the input dictionary of supported CIF categories. The latest version of this dictionary can be found on the RCSB user guide

See also

• OEGetMMCIFData function to get mmCIF data

• OESetMMCIFData function to add mmCIF data

• section_moldata_MMCIF section