Me:
> Perhaps you want Chem.MolFragmentToSmiles(mol, atomsToUse=idxs)?
> 
> http://www.rdkit.org/docs-beta/api/rdkit.Chem.rdmolfiles-module.html#MolFragmentToSmiles

Err, umm, *blush*. Forgot which list I was reading.

[Andrew! It says it right in the subject line! :]

                                Andrew
                                da...@dalkescientific.com


------------------------------------------------------------------------------
Check out the vibrant tech community on one of the world's most
engaging tech sites, Slashdot.org! http://sdm.link/slashdot
_______________________________________________
OpenBabel-discuss mailing list
OpenBabel-discuss@lists.sourceforge.net
https://lists.sourceforge.net/lists/listinfo/openbabel-discuss

Reply via email to