OEGetAtomMatchResidueIDs

std::vector<OEAtomMatchResidueID> OEGetAtomMatchResidueIDs(const OEChem::OEMolBase& mol);

Retrieves the following properties for each residue in the molecule:

• residue name

• residue number

• insertion code

• chain ID

• fragment number

• alternate location.

See also

• OEResidue class

• Residue Data Functors section

• OEAtomMatchResidue class

• OEAtomMatchResidueID class