From: Jiao, D. <dj...@in...> - 2007-07-25 16:37:42
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I think both 24 hits / 2 hits are right, depending on whether you think the benzene ring as a whole unit or each carbon atom. The daylight depict tool gives both results. I am not quite sure how these number are calculated in CDK. David Rajarshi Guha wrote: > > On Jul 25, 2007, at 12:17 PM, Jiao, Dazhi wrote: > >> Hi, Rajarshi, >> >> As you may recall, we have two implementation of smarts parsers in CDK >> right now. If you use the class >> >> org.openscience.cdk.smiles.smarts.parser.SMARTSParser > > Thanks, this works. But I get 24 matches - shouldn't I be getting 2 > matches? > > ------------------------------------------------------------------- > Rajarshi Guha <rg...@in...> > GPG Fingerprint: 0CCA 8EE2 2EEB 25E2 AB04 06F7 1BB9 E634 9B87 56EE > ------------------------------------------------------------------- > Absence is to love what wind is to fire. It extinguishes the small, > it enkindles the great. > > |