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AgeCommit message (Expand)Author
2016-05-08default validations fixedChristoph Helma
2016-05-07-log10 for regression datasets, test cleanupsChristoph Helma
2016-05-06dataset tests cleanupChristoph Helma
2016-05-05ambit mirror, import from mirrored json, proteomics importChristoph Helma
2016-04-28compound classification fixedChristoph Helma
2016-04-15data_entries removed from datasets. datasets are now just containers for comp...Christoph Helma
2016-04-14features/toxicities fixedChristoph Helma
2016-04-13improved enm importChristoph Helma
2016-04-13validation tests passChristoph Helma
2016-04-12new dataset structureChristoph Helma
2016-04-08enm import testChristoph Helma
2016-03-14descriptor testsChristoph Helma
2016-02-28physchem calculation and storage in compoudsChristoph Helma
2016-02-28physchem feature classChristoph Helma
2016-02-27local pls regression as default regression algorithmfminerChristoph Helma
2016-02-09pls regressionChristoph Helma
2016-01-08mg-mmol conversion fixedChristoph Helma
2015-11-09leave one out validation implementedChristoph Helma
2015-11-04Merge branch 'development' of github.com:opentox/lazar into developmentChristoph Helma
2015-11-04neighbor search delegated to database backendChristoph Helma
2015-10-29Removed comment.davor
2015-10-29Added molecular weight to compound and mg conversionsdavor
2015-10-29check for whitespaces in smilesChristoph Helma
2015-10-29avoid duplicated obconversion in from_smilesgebele
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
2015-09-10tests fixed (crossvalidations may fail due to memory constraints)Christoph Helma
2015-08-27Initial GUI for Nestec modelsChristoph Helma
2015-08-25Experiments addedChristoph Helma
2015-08-24Model::Prediction with tests, initial indexesv0.0.8Christoph Helma
2015-08-19name conversion fixedv1.0.0beta1Christoph Helma
2015-08-19hydrogens added for 3d generationChristoph Helma
2015-08-19libfminer rpath fixed, installation instructionsChristoph Helma
2015-08-18initial installation fixes, installs on Debian 3.16.7ch
2015-08-13majority of tests workingChristoph Helma
2015-08-13OpenBabel can (canonical smiles) instead of inchi as internal identifier to a...Christoph Helma
2015-08-10algorithm libraries added, fminer tests passChristoph Helma
2015-08-10transfer to new git project startedChristoph Helma
2015-08-09customized prediction algorithms implementedChristoph Helma
2015-08-07initial k-nn weighted average implementationChristoph Helma
2015-07-31intermediary commitChristoph Helma
2015-07-31descriptor tests workingChristoph Helma
2015-07-27reasonable query performace for data_entriesChristoph Helma
2015-07-22mongo batch import workaroundChristoph Helma
2015-07-19lazar predictions working in principleChristoph Helma
2015-07-18dataset tests passChristoph Helma
2015-07-12initial dataset testsch
2014-10-10fix error msgmguetlein
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