Curt & Greg, Thx for clarification. > But it's not clear to me why you would need to query in this way.
in my code I use(d) smarts as a smiles with extra features ("regex", atom numbering). As far as I remember I had some problem with smiles and therefore decided to switch to smarts. Now I back to smiles-version and realized the problem is in different place and smarts only mask true problem. Thanks again for comments and explanations. Best, RafaĆ ------------------------------------------------------------------------------ Check out the vibrant tech community on one of the world's most engaging tech sites, Slashdot.org! http://sdm.link/slashdot _______________________________________________ Rdkit-discuss mailing list Rdkit-discuss@lists.sourceforge.net https://lists.sourceforge.net/lists/listinfo/rdkit-discuss