tag:blogger.com,1999:blog-50717690020168176362012-02-16T07:28:39.284-08:00Egon Willighagennoreply@blogger.comBlogger21100tag:blogger.com,1999:blog-5071769002016817636.post-70904775945442100392008-03-21T13:58:00.000-07:002008-04-08T01:51:16.056-07:00In this article we describe the design and use of a set of Java classes to represent pharmacophores and use such representations in pharmacophore searching applications.<br /><br />Read the <a href="http://www.steinbeck-molecular.de/cdknews/index.php/CDKNews/article/view/29">article</a>.<div class="blogger-post-footer"><img width='1' height='1' src='https://blogger.googleusercontent.com/tracker/5071769002016817636-7090477594544210039?l=cdknewsasap.blogspot.com' alt='' /></div>Egon Willighagennoreply@blogger.com0tag:blogger.com,1999:blog-5071769002016817636.post-25946004596119069192007-07-14T09:53:00.001-07:002008-04-08T01:51:43.512-07:00This article presents recent work that is aimed at the development of the RDF Proton Descriptors in CDK. The file RDFProtonDescriptor class has been splitted in five distinct classes, each containing a separate RDF proton descriptor.<br /><br />Read <a href="http://www.steinbeck-molecular.de/cdknews/index.php/CDKNews/article/view/24">the article</a>.<div class="blogger-post-footer"><img width='1' height='1' src='https://blogger.googleusercontent.com/tracker/5071769002016817636-2594600459611906919?l=cdknewsasap.blogspot.com' alt='' /></div>Egon Willighagennoreply@blogger.com0