Dear all, sorry for cross-posting so heavily.
Peter Murray-Rust informed me about the follwing, which, I think, is really excellent news for CDK and JChemPaint:
The European Chemicals Bureau http://ecb.jrc.it/ which runs REACH http://ecb.jrc.it/REACH/ has commissioned an in silico toxicology prediction suite toxTree. This is based on the CDK toolkit, is built on CML, and is released as OpenSource under the GPL - see
http://ecb.jrc.it/DOCUMENTS/QSAR/TOXTREE/toxTree_user_manual.pdf Cheers, Chris -- Priv. Doz. Dr. Christoph Steinbeck ([EMAIL PROTECTED]) Head of the Research Group for Molecular Informatics Cologne University BioInformatics Center (http://almost.cubic.uni-koeln.de) Zülpicher Str. 47, 50674 Cologne Tel: +49(0)221-470-7426 Fax: +49 (0) 221-470-7786 What is man but that lofty spirit - that sense of enterprise. ... Kirk, "I, Mudd," stardate 4513.3.. ------------------------------------------------------- This SF.Net email is sponsored by xPML, a groundbreaking scripting language that extends applications into web and mobile media. Attend the live webcast and join the prime developer group breaking into this new coding territory! http://sel.as-us.falkag.net/sel?cmd=lnk&kid0944&bid$1720&dat1642 _______________________________________________ Cdk-user mailing list [email protected] https://lists.sourceforge.net/lists/listinfo/cdk-user
