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AgeCommit message (Expand)Author
2015-09-10tests fixed (crossvalidations may fail due to memory constraints)Christoph Helma
2015-09-09fminer classification fixedChristoph Helma
2015-08-25Experiments addedChristoph Helma
2015-08-20crossvalidation fixesv0.0.7Christoph Helma
2015-08-13OpenBabel can (canonical smiles) instead of inchi as internal identifier to a...Christoph Helma