http://depth-first.com/articles/2006/08/24/scripting-cdk-with-jruby en-us 40 Walking the Web of Chemical Informatics <p><img src="http://depth-first.com/files/jruby.png" align="right"></img>A <a href="http://depth-first.com/articles/2006/08/23/scripting-octet-with-jruby">previous article</a> discussed the use of the Java chemical informatics library Octet from JRuby. This article will discuss the use of another Java chemical infomatics library, <a href="http://cdk.sf.net">CDK</a>, from JRuby. A small Ruby class will be developed that generates a molfile with completely assigned 2-D coordinates from a SMILES string.</p> Thu, 24 Aug 2006 14:04:00 +0000 urn:uuid:5a77ebcd-52e5-4404-b2cb-ac5ef7888f2f Rich Apodaca http://depth-first.com/articles/2006/08/24/scripting-cdk-with-jruby Tools cdk jruby java integration