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

bool OEScreen(const OESubSearchScreen &query,
              const OESubSearchScreen &target)

Returns whether an OESubSearchScreen object generated for a target molecule can be matched to the OESubSearchScreen object generated for a query molecule.



All screens provided by OEChem TK are rigorously tested to make sure that they do not eliminate any matches that would succeed when utilizing the more elaborate atom-by-atom substructure search algorithm.

See also