Fingerprinting doesn't take into account stereochem and as far as a I know the UIT doesn't eitehr
On Mon, Nov 8, 2010 at 2:40 AM, Thomas Strunz <beginn...@hotmail.de> wrote: > Hi all, > > does the Fingerprinter and the UnversialIsomorphismTester also consider > stereo-chemistry? > > Is it possible to change the behavior? As far as I can see it isn't. > > What is the behavior considering "flat" structure (undetermined > stereo-chemistry) and a non-flat one. Is the flat one a subgrapgh and/or > isomorphic to the one with stereo-chemistry? > What about the fingerprints? > > Best Regards, > > Thomas > > > > ------------------------------------------------------------------------------ > What happens now with your Lotus Notes apps - do you make another costly > upgrade, or settle for being marooned without product support? Time to move > off Lotus Notes and onto the cloud with Force.com, apps are easier to build, > use, and manage than apps on traditional platforms. Sign up for the Lotus > Notes Migration Kit to learn more. http://p.sf.net/sfu/salesforce-d2d > _______________________________________________ > Cdk-user mailing list > Cdk-user@lists.sourceforge.net > https://lists.sourceforge.net/lists/listinfo/cdk-user > > -- Rajarshi Guha NIH Chemical Genomics Center ------------------------------------------------------------------------------ What happens now with your Lotus Notes apps - do you make another costly upgrade, or settle for being marooned without product support? Time to move off Lotus Notes and onto the cloud with Force.com, apps are easier to build, use, and manage than apps on traditional platforms. Sign up for the Lotus Notes Migration Kit to learn more. http://p.sf.net/sfu/salesforce-d2d _______________________________________________ Cdk-user mailing list Cdk-user@lists.sourceforge.net https://lists.sourceforge.net/lists/listinfo/cdk-user
