OEMonomerValidationReturnCode

Attention

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

The OEMonomerValidationReturnCode namespace contains codes representing the success or various issues of monomer validation when using the OEIsValidMonomerData function.

See also

• OEMonomerData class

• OEMonomerValidationResult class

It contains the following constants:

Success

Represents that the monomer is valid.

InvalidMonomerCode

The monomer code is invalid:

• empty string or more the 20 character long

• contains character other than: alphanumerical, - (dash), _ (underscore), ( or ) or , (comma)

• UNK is a reserved name and should nt be used as a monomer code

InvalidMonomerRGroups

If the monomer has any invalid connection point defined my R-group map index.

InvalidMonomerSmiles

The monomer smiles is invalid, if the OEParseSmiles function return false.

InvalidMonomerType

The monomer type is invalid or does not match to the type returned by the OEGetMonomerType function.

InvalidPolymerType

The polymer type is invalid or does not match to the type returned by the OEGetPolymerType function.

MissingMonomerCode

If the monomer has not code specified for any code-set.

MissingMonomerRGroups

If the monomer has no connection point defined my R-group map index.

MissingMonomerSmiles

If no smiles specified for the monomer structure.

UnspecifiedAtomStereo

A monomer unspecified stereo at a chiral atom is considered invalid.

UnspecifiedBondStereo

A monomer unspecified bond at a chiral bond is considered invalid.