Hosting CDK on AppEngine (java)

Release history

Jun 20, 2009

Version 3.

Using CDK jar version 1.2.3
Substructure Searching supported. That means the CDK SMARTS searching function works.
Similar Structure Searching (Tanimoto) supported.
Has a domain name www.chemdeposit.com

Jun 15, 2009

First release. CDK works on Appengine.

Failed Cases

InChI Generator

Code

InChIGeneratorFactory factory = new InChIGeneratorFactory();
InChIGenerator gen = factory.getInChIGenerator(molecule);
resp.getWriter().println(gen.getInchi());

java.security.AccessControlException

access denied (java.io.FilePermission C:\Documents and Settings\<user name>\jniinchi.properties read)
at net.sf.jniinchi.JniInchiNativeCodeLoader.loadProperties(JniInchiNativeCodeLoader.java:166)
at org.openscience.cdk.inchi.InChIGeneratorFactory.<init>(InChIGeneratorFactory.java:68)