A Java based cheminformatics (computational chemistry) library



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SVN available!   fechner 2009-06-14 13:30 - JOELib/JOELib2
Subversion version management system is now available.

Graph Mining papers (Graph Kernel and Maximum Common Subst.)   wegner 2006-01-30 08:40 - JOELib/JOELib2
Two actual papers are published in the 'QSAR & Comb. Chem.' journal http://dx.doi.org/10.1002/qsar.200510135 and http://dx.doi.org/10.1002/qsar.200510009
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ACS Meeting 2005 - JOELib: Graph/Data Mining and Clustering   wegner 2005-02-23 02:58 - JOELib/JOELib2
We present two lectures at the ACS meeting (http://www.chemistry.org) discussing results for graph mining, data mining and clustering. All results were obtained by using JOELib (some unpublished work), the Weka and Spider machine learning libraries.
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