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2015-08-09crossvalidation.rb, neighbor.rb addedmongodbChristoph Helma
2015-08-09customized prediction algorithms implementedChristoph Helma
2015-08-07initial k-nn weighted average implementationChristoph Helma
2015-08-04validation.rb addedChristoph Helma
2015-08-03initial classification validationChristoph Helma
2015-08-01more timer detailsChristoph Helma
2015-08-0150 times faster bbrc setup by eliminating @fminer.add_fminer_dataChristoph Helma
2015-07-31intermediary commitChristoph Helma
2015-07-31descriptor tests workingChristoph Helma
2015-07-29kazius lazar predictions workingChristoph Helma
2015-07-29bbrc features for kazius with minfreq 20 successfully created and storedChristoph Helma
2015-07-27reasonable query performace for data_entriesChristoph Helma
2015-07-21intermediary commit before switching to generalised storage modelChristoph Helma
2015-07-20lazar-fminer classification passes testChristoph Helma
2015-07-19lazar predictions working in principleChristoph Helma
2015-07-18initial bbrc parsing fix. speedup ~65 timesChristoph Helma
2015-07-18trying to speed up bbrc parsingChristoph Helma
2015-07-02API: add descriptor get routesrautenberg
2015-07-02API: add descriptor get routesrautenberg
2015-07-02API: post /fminer/bbrc and /fminer/last set param prediction_feature to reque...rautenberg
2015-07-02API: add routes post: /fminer/bbrc and /fminer/lastrautenberg
2015-06-25add default accept type for representations in APIrautenberg
2015-06-25add more routes to APIrautenberg
2015-06-25add /algorithm/lazar/predict route to APIrautenberg
2015-06-18hotfix for wrong PATH_INFO in request env /algorithm/api/algorithm.json is /a...rautenberg
2015-06-18hotfix for wrong PATH_INFO in request env /algorithm/api/algorithm.json is /a...rautenberg
2015-06-18initial swagger API docs for algorithm/lazarrautenberg
2014-11-05fixed type definitiongebele
2014-10-30provide descriptor valuesmguetlein
2014-10-30add arom detection to cdk feature generationmguetlein
2014-10-21fix lazar regression prediction for more than one compoundmguetlein
2014-10-21fix lazar regression prediction for more than one compound, copy old predicti...mguetlein
2014-10-17add babel_3d_cache folder, second try (deleteing the dummy file does delete t...mguetlein
2014-10-17remove file within dir againmguetlein
2014-10-17Merge branch 'development' of ssh://github.com/opentox/algorithm into develop...mguetlein
2014-10-17addding babel_3d_cache directorymguetlein
2014-10-16Fixed env variable for R install.ist
2014-10-10add per compound caching for 3d generationmguetlein
2014-10-10extend model building and prediction to accept feature_dataset_uri (instead o...mguetlein
2014-10-10fix cdkdescriptor calculation: find classes with 'descriptor' in the middle o...mguetlein
2014-10-10recommit with correct descriptor.rb: fix storing feature datasets for dataset...mguetlein
2014-10-10Revert "fix storing feature datasets for dataset with duplicate compounds, pr...mguetlein
2014-10-10Merge branch 'development' of ssh://github.com/opentox/algorithm into develop...mguetlein
2014-10-10fix storing feature datasets for dataset with duplicate compounds, preserve f...mguetlein
2014-10-09Use system variable for R mirror.davor
2014-10-08cdk descriptor class can now compoute single feature values (e.g. Cdk.ALOGP.A...mguetlein
2014-10-08raise error when external program fails (i.e., cdk or joelib)mguetlein
2014-10-07fix calculation of cdk features for test compounds, fix error with missing va...mguetlein
2014-10-07fix 3d structure caching, add debug messages for descriptor calculation (this...mguetlein
2014-10-07print status in cdk desc calculation, this may take some timemguetlein