Hello, I am generating conformers.
When I write them out, I'd like that they are named like this: molName_001 molName_002 ... So that, down the line, I know with which conformer of which molecule I am working with. So: "parent" molecule name followed by one '_' then the conformer Id in a fixed format. Is it possible to do so with a Chem.SDWriter? Thanks a lot, Francois. ------------------------------------------------------------------------------ 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
