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AgeCommit message (Expand)Author
2018-10-29dataset predictions fixedhelma@in-silico.ch
2018-10-10compound name resolution from pubchem, chembl disabledhelma@in-silico.ch
2018-10-09tentative random forest classification: hangs unpredictably during caret mode...mutanewhelma@in-silico.ch
2018-01-17changed assertion valuegebele
2017-06-09added addressable gem to avoid URI::InvalidURIErrorgebele
2016-10-13compound tests fixedChristoph Helma
2016-10-13descriptor tests fixedChristoph Helma
2016-10-13test_physchem fixedChristoph Helma
2016-10-13molecular_weight fixedChristoph Helma
2016-10-05compound and descriptor tests fixedChristoph Helma
2016-06-01all tests fixedChristoph Helma
2016-05-13compound tests fixedChristoph Helma
2016-05-07-log10 for regression datasets, test cleanupsChristoph Helma
2016-03-14descriptor testsChristoph Helma
2016-02-28physchem calculation and storage in compoudsChristoph Helma
2015-11-04Merge branch 'development' of github.com:opentox/lazar into developmentChristoph Helma
2015-11-04neighbor search delegated to database backendChristoph Helma
2015-10-29Added molecular weight to compound and mg conversionsdavor
2015-10-08version bump, experiment tests skippedChristoph Helma
2015-10-08crossvalidation plots, original classification confidenceChristoph Helma
2015-10-07generalised fingerprintsChristoph Helma
2015-09-23validations fixed (all models were executed with default parameters)Christoph Helma
2015-09-17neighbor calculation moved to Compound classChristoph Helma
2015-09-16generic openbabel fingerprintsChristoph Helma
2015-08-24Model::Prediction with tests, initial indexesv0.0.8Christoph Helma
2015-08-19libfminer rpath fixed, installation instructionsChristoph Helma
2015-08-18initial installation fixes, installs on Debian 3.16.7ch
2015-08-13OpenBabel can (canonical smiles) instead of inchi as internal identifier to a...Christoph Helma
2015-08-10transfer to new git project startedChristoph Helma
2012-04-26tests removed, URI.accessible? check temporarily removedChristoph Helma
2012-02-08toxbank-investigation compatible versionChristoph Helma
2012-01-13compound addedChristoph Helma