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molbace

Benchmarks

Task NameDataset NameSOTA ResultTrend
Graph ClassificationMOLBACE
ROC AUC0.8037
31
Classificationmolbace OGB (test)
ROC-AUC77.27
16
Graph ClassificationMolbace scaffold split
ROC AUC0.7911
14
Graph ClassificationMolbace size split
ROC AUC83.68
14
Classificationmolbace OGB
ROC-AUC0.7727
8
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