Results 1 to 1 of 1
Thread: Chemistry Development Kit 1.0.1
- 06-26-2007, 10:37 PM #1
Chemistry Development Kit 1.0.1
The Chemistry Development Kit (CDK) is a library of Java classes for chemo-, bioinformatics, computational chemistry, and chemometrics. It provides important algorithms like substructure search, SMILES, Gasteiger charges, QSAR descriptor calculation, 3D structure generation, 2D layout and rendering, many IO formats, atom typing, and more.
This release consists of mostly some bugfixes, but also solves a few Java 1.4.2 compile problems and adds more functionality to the SMARTS parser.
- By ray.lou in forum Jobs WantedReplies: 5Last Post: 01-04-2010, 05:09 PM
- By Albert in forum Enterprise JavaBeans (EJB)Replies: 1Last Post: 07-06-2007, 08:29 AM
- By JavaForums in forum EclipseReplies: 0Last Post: 04-26-2007, 11:15 AM