On Tuesday 06 March 2007 12:09:30 Yann Mauon wrote: > Thanks for your answer. In fact, I'm talking about xml (or asn) file > provided by nist at the following format : > > <PC-Compound> > <PC-Compound_id> > <PC-CompoundType> > <PC-CompoundType_id> > <PC-CompoundType_id_cid>2244</PC-CompoundType_id_cid> > </PC-CompoundType_id> > </PC-CompoundType> > </PC-Compound_id> > <PC-Compound_atoms> > <PC-Atoms> > <PC-Atoms_aid> > <PC-Atoms_aid_E>1</PC-Atoms_aid_E> > <PC-Atoms_aid_E>2</PC-Atoms_aid_E>
BTW, this rather looks like the format used by PubChem. CDK does have a basic reader for files in the PubChem ASN syntax. Maybe that's a viable alternative for you. Egon -- CUBIC blog: http://chem-bla-ics.blogspot.com/ ------------------------------------------------------------------------- Take Surveys. Earn Cash. Influence the Future of IT Join SourceForge.net's Techsay panel and you'll get the chance to share your opinions on IT & business topics through brief surveys-and earn cash http://www.techsay.com/default.php?page=join.php&p=sourceforge&CID=DEVDEV _______________________________________________ Cdk-user mailing list [email protected] https://lists.sourceforge.net/lists/listinfo/cdk-user
