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path: root/lib/descriptor.rb
AgeCommit message (Expand)Author
2016-03-14descriptor testsChristoph Helma
2016-02-29crossvalidation folds fixed for duplicatesChristoph Helma
2016-02-28physchem feature classChristoph Helma
2015-11-04neighbor search delegated to database backendChristoph Helma
2015-09-23validations fixed (all models were executed with default parameters)Christoph Helma
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