OEGetStandardAnalog

Attention

This is a preliminary API and may be improved based on user feedback. It is currently available in C++ and Python.

unsigned int OEGetStandardAnalog(const std::string& monomerSmiles)

Returns the residue index of the standard amino acid (from the OEResidueIndex namespace) that are most similar to monomer represented by the given SMILES, or OEResidueIndex::UNK if the monomer is not considered an analog.