The Chemistry Development Kit
Description
The Chemistry Development Kit (CDK) is a scientific, LGPL-ed library for bio- and cheminformatics and computational chemistry written in Java.
Features
- Read and write chemical data formats
- Render chemical structures
- Algorithms for chemical graph theory
- QSAR descriptors
Update Notifications
User Ratings
User Reviews
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I came across Egon’s book on Chemistry Development Kit (CDK) when I was looking for a tutorial or a book to getting started with CDK. I was a computational biochemist by training, but never being exposed to Cheminformatics. I had very little time to get up to speed with CDK for a Java based software project.