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Ish: Guided Ensemble Stacking Method for Predicting Biological Activities of Compounds
MoleculeNet: a benchmark for molecular machine learning
Zhenqin Wu, Bharath Ramsundar, Evan N. Feinberg +5
Maqola20176 iqtibosABIDeepTox: Toxicity Prediction using Deep Learning
Andreas Mayr, Günter Klambauer, Thomas Unterthiner +1
Maqola20162 iqtibosABIQSAR Modeling: Where Have You Been? Where Are You Going To?
Artem Cherkasov, Eugene Muratov, Denis Fourches +17
Maqola20132 iqtibosABI