Wow, that was quick! Thank's a lot. Very much appreciated.
Andreas Egon Willighagen wrote: > On Thu, Apr 17, 2008 at 1:51 PM, Andreas Schüller > <[EMAIL PROTECTED]> wrote: >> It took us actually about an hour to figure this out... >> I would prefer a simpler way such as: >> >> IMolecule molecule = (IMolecule) mol2Reader.read( >> DefaultChemObjectBuilder.getInstance().newMolecule()); > > At your service. If only all requests were as easy as these :) > > Egon > -- Andreas Schüller PhD student in the research group of Prof. Dr. Gisbert Schneider Johann Wolfgang Goethe University Beilstein-endowed Chair for Chemoinformatics Building B - 3rd floor Siesmayerstr. 70 60323 Frankfurt am Main Germany Tel.: +49 69 798 24879 Fax: +49 69 798 24880 http://www.modlab.de/ ------------------------------------------------------------------------- This SF.net email is sponsored by the 2008 JavaOne(SM) Conference Don't miss this year's exciting event. There's still time to save $100. Use priority code J8TL2D2. http://ad.doubleclick.net/clk;198757673;13503038;p?http://java.sun.com/javaone _______________________________________________ Cdk-user mailing list [email protected] https://lists.sourceforge.net/lists/listinfo/cdk-user
