Age | Commit message (Expand) | Author |
2021-03-08 | neighbor selction adjusted, summary for high-confidence predictions | Christoph Helma |
2021-03-08 | cdk predictions fixed | Christoph Helma |
2021-02-12 | model.rb refactored, mp2d models updated | Christoph Helma |
2020-12-28 | file prediction output updated | Christoph Helma |
2020-10-13 | mutagenicity downloads moved, PaDEL metadata | Christoph Helma |
2019-09-07 | obsolete data and java directories deleted | Christoph Helma |
2019-08-24 | obsolete files removed | Christoph Helma |
2019-08-24 | initial refactored version for mutagenicity paper | Christoph Helma |
2019-08-19 | temporary commit before branching - Dataset.from_descriptor_csv_file is broken | Christoph Helma |
2019-08-19 | property import from csv file | Christoph Helma |
2019-08-19 | Merge branch 'development' of ssh://git.in-silico.ch:2222/home/ist/public/laz...development | Christoph Helma |
2019-08-19 | sdf export fixed | Christoph Helma |
2019-08-18 | fingerprint csv export | Christoph Helma |
2019-07-16 | always render new correlation plot; keep same handling as for probability plot | gebele |
2019-07-12 | fixed, probability plot format was not taken from params for filename | gebele |
2019-06-27 | fixed confidence value for cv stats; added tests | gebele |
2019-06-21 | measurement added for single neighbors | Christoph Helma |
2019-06-21 | test_from_csv2 fixed, prefer merged_feature and transformed_feature in to_tra... | Christoph Helma |
2019-06-20 | separate csv serialisations for batch predictions and training data, repeated... | Christoph Helma |
2018-11-16 | confidence for prediction datasets | helma@in-silico.ch |
2018-11-16 | minor test fixes | helma@in-silico.ch |
2018-11-16 | real datasets for testing, test data cleanup, Daphnia import, upper and lower... | helma@in-silico.ch |
2018-11-14 | bad_request_error substituted with ArgumentError | helma@in-silico.ch |
2018-11-14 | public model validation, updated documentation | helma@in-silico.ch |
2018-11-13 | public dataset download | helma@in-silico.ch |
2018-11-12 | Mutagenicity download | helma@in-silico.ch |
2018-11-12 | PubChem classification download | helma@in-silico.ch |
2018-11-06 | sdf export fixed | helma@in-silico.ch |
2018-11-02 | warnings fixed, cleanup | helma@in-silico.ch |
2018-10-31 | pubchem import for openrisknet | helma@in-silico.ch |
2018-10-30 | dataset merge | helma@in-silico.ch |
2018-10-30 | tests fixed | helma@in-silico.ch |
2018-10-30 | regression feature names fixed | helma@in-silico.ch |
2018-10-29 | dataset predictions fixed | helma@in-silico.ch |
2018-10-29 | dataset folds fixed | helma@in-silico.ch |
2018-10-25 | dataset merge | helma@in-silico.ch |
2018-10-24 | dataset tests fixed | helma@in-silico.ch |
2018-10-24 | dataset mapfeature_classes | helma@in-silico.ch |
2018-10-12 | validation statistic fixes | helma@in-silico.ch |
2018-10-11 | initial dataset batch prediction | helma@in-silico.ch |
2018-10-10 | dataset tests fixed | helma@in-silico.ch |
2018-10-10 | compound name resolution from pubchem, chembl disabled | helma@in-silico.ch |
2018-10-10 | more differentiated feature classes | helma@in-silico.ch |
2018-10-09 | tentative random forest classification: hangs unpredictably during caret mode...mutanew | helma@in-silico.ch |
2018-10-07 | dataset merge with feature/value maps | helma@in-silico.ch |
2018-10-05 | partial pubchem classification import | helma@in-silico.ch |
2018-10-05 | sdf import, csv files with id column | helma@in-silico.ch |
2018-09-17 | smiles as identifier for sdf export | helma@in-silico.ch |
2018-09-06 | adjusted classification similarities, dataset sdf export | helma@in-silico.ch |
2018-08-14 | classification min_sim=0.5, 5 repeated cvs | helma@in-silico.ch |