ResearchBenchmarksClassification on Tox21 (top-k counts)Follow9Top-1 CountN-Gram XGB-0.362.074.56.93Jun 24, 2018Evaluation ResultsMethodMethodLinksTop-1 CountTop-3 CountN-Gram XGBN-gram parameter T=6,...N-gram parameter T=6, Embedding dimension r=1002018.06912N-Gram RFN-gram parameter T=6,...N-gram parameter T=6, Embedding dimension r=1002018.06312WL SVM2018.0602Morgan RF2018.0607GCNN2018.0602Weave2018.0601