Tim, I am using OB trunk and after updating, I notice that the new canonical smiles differ strongly from the ones previously generated. Is this normal?
Gert On Sep 15, 2010, at 4:46 PM, Tim Vandermeersch wrote: > > Are you using OB trunk? If so, the canonical coding algorithm is slow > at the moment but this should be improved in the next couple of days. > > Tim > ------------------------------------------------------------------------------ Start uncovering the many advantages of virtual appliances and start using them to simplify application deployment and accelerate your shift to cloud computing. http://p.sf.net/sfu/novell-sfdev2dev _______________________________________________ OpenBabel-Devel mailing list OpenBabel-Devel@lists.sourceforge.net https://lists.sourceforge.net/lists/listinfo/openbabel-devel
