Re: [Rdkit-discuss] New MMFF-enabled RDKit branch

Well done Paolo! During last year's UGM, when Greg asked for an RDKit wishlist from the audience, this functionality was suggested by more than one person. Thanks! JP On 23 August 2013 04:28, Greg Landrum greg.land...@gmail.com wrote: Thanks Paolo! I think it will be great for the RDKit to

Re: [Rdkit-discuss] GetSubstructMatches()

Indeed with the latest release there is no problem any more. Ling From: Greg Landrum greg.land...@gmail.com To: S.L. Chan slch...@yahoo.com Cc: rdkit-discuss@lists.sourceforge.net rdkit-discuss@lists.sourceforge.net Sent: Thursday, August 22, 2013 6:57 PM