Hi Hari, On Thu, Feb 3, 2011 at 4:47 PM, hari jayaram <[email protected]> wrote: > I have some rdkit code that calculates the Lipinski parameters for a given > rdkitmoleule. > I am working with someone who wants to port this code to java. I know very > little about swig or  jython but wondering what the best way to accomplish > an equivalent functionality using rdkit within a java ecosystem would be. > Is there a jar file readily available for rdkit whereby one could write this > function in java . I did see some swig examples on the wiki that did this > from c code...but I dont know how to apply that to my case.
There is not currently a convenient way to use the RDKit from java. We're currently working on something that should be ready in the next month or so that will make things easier than they are now. I will post an announcement when it's ready. Best Regards, ------------------------------------------------------------------------------ Special Offer-- Download ArcSight Logger for FREE (a $49 USD value)! Finally, a world-class log management solution at an even better price-free! Download using promo code Free_Logger_4_Dev2Dev. Offer expires February 28th, so secure your free ArcSight Logger TODAY! http://p.sf.net/sfu/arcsight-sfd2d _______________________________________________ Rdkit-discuss mailing list [email protected] https://lists.sourceforge.net/lists/listinfo/rdkit-discuss
