Hi Joos,

On Sun, Feb 5, 2012 at 6:34 PM, Joos Kiener <[email protected]> wrote:
> for my Master Thesis in computer science (Master of Advanced Studies) I have
> created a simple framework based on the CDK for storing and searching
> chemical structures in a relational database.

How does it optimize substructure searching?

> Note that newest
> CDK versions won't work as IMolecule interface is used in the framework.
> Will need to change that for next release.

CDK 1.4.x will be the stable release for at least the next 6 months...
Also, the 'master' branch is far from being frozen and we expect more
API changes... just keep that in mind :)

Egon

-- 
Dr E.L. Willighagen
Postdoctoral Researcher
Department of Bioinformatics - BiGCaT
Maastricht University (http://www.bigcat.unimaas.nl/)
Homepage: http://egonw.github.com/
LinkedIn: http://se.linkedin.com/in/egonw
Blog: http://chem-bla-ics.blogspot.com/
PubList: http://www.citeulike.org/user/egonw/tag/papers

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