On Monday 23 June 2008 04:41:23 Rajarshi Guha wrote: > Hi, does the CDK have methods for detection of stereocenters > (tetrahedral, cis/trans etc)? Going one step further, has anybody Yes. See org.openscience.cdk.geometry.BondTools, methods like isStereo, isTetrahedral etc. > ever looked at enumeration of stereoisomers? No (at least not me). > > ------------------------------------------------------------------- > Rajarshi Guha <[EMAIL PROTECTED]> > GPG Fingerprint: D070 5427 CC5B 7938 929C DD13 66A1 922C 51E7 9E84 > ------------------------------------------------------------------- > The most important statistic for car manufacturers is autocorrelation. > > > > ------------------------------------------------------------------------- > Check out the new SourceForge.net Marketplace. > It's the best place to buy or sell services for > just about anything Open Source. > http://sourceforge.net/services/buy/index.php > _______________________________________________ > Cdk-user mailing list > [email protected] > https://lists.sourceforge.net/lists/listinfo/cdk-user
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