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AgeCommit message (Expand)Author
2016-10-13classification fixedChristoph Helma
2016-10-13descriptor tests fixedChristoph Helma
2016-10-13test_physchem fixedChristoph Helma
2016-10-13molecular_weight fixedChristoph Helma
2016-10-12R NAs fixedChristoph Helma
2016-10-12physchem regression, correlation_filter for fingerprintsChristoph Helma
2016-10-07README.md updatedChristoph Helma
2016-10-07remaining tests fixedChristoph Helma
2016-10-07unified interface for prediction algorithmsChristoph Helma
2016-10-06nano caret regression fixedChristoph Helma
2016-10-05classification and regression testsChristoph Helma
2016-10-05compound and descriptor tests fixedChristoph Helma
2016-10-05substance and nanoparticle model creation and predictionsChristoph Helma
2016-10-03initial model creation testsChristoph Helma
2016-09-30npo uri as source, spectral count unit f proteomics featuresChristoph Helma
2016-09-26pubchem uri fixedathens-workshopChristoph Helma
2016-09-26 resource_not_found_error changed to not_found_error to match new RestClien...Christoph Helma
2016-09-26Chembl URI fixedChristoph Helma
2016-09-26CACTUS_URI updatedChristoph Helma
2016-09-13updated copyright dateMicha Rautenberg
2016-07-26NanoPrediction modelChristoph Helma
2016-07-25local_weighted_average fallback fixed, cv predictions pulled from validations...Christoph Helma
2016-07-21correlation plot fixedChristoph Helma
2016-06-08compound tests fixedChristoph Helma
2016-06-07(repeated)crossvalidation plotsChristoph Helma
2016-06-03random forest regressionChristoph Helma
2016-06-02proteomics regression validationChristoph Helma
2016-06-02local pls regression for nanoparticle proteomicsChristoph Helma
2016-06-02local pls regression for nanoparticlesChristoph Helma
2016-06-01all tests fixedChristoph Helma
2016-06-01validation tests fixedChristoph Helma
2016-05-31cleanup of validation modules/classesChristoph Helma
2016-05-27first correlation of nanoparticle predictionsChristoph Helma
2016-05-24tests fixed. DescriptorTest#test_compound_all may fail within all.rbChristoph Helma
2016-05-24dataset tests fixedChristoph Helma
2016-05-13compound tests fixedChristoph Helma
2016-05-12enm study import fixedChristoph Helma
2016-05-10-log10 transformed datasets addedChristoph Helma
2016-05-09enm test data addedChristoph Helma
2016-05-09development branch mergedv0.9.3Christoph Helma
2016-05-09physchem crossvalidation fixed, test_compound_descriptor_parameters assertion...Christoph Helma
2016-05-09nanoparticle models fixedChristoph Helma
2016-05-09physchem crossvalidation fixedChristoph Helma
2016-05-08regression crossvalidation fixedChristoph Helma
2016-05-08default validations fixedChristoph Helma
2016-05-08gridfs test addedChristoph 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
2016-05-04first reasonable results for nanoparticle crossvalidationChristoph Helma
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