BioAct-Het

Reported on 6 benchmarks across 2 tasks

Note: results are matched by exact model name. Different papers may use the same name for different model variants.

Methodology3 results

Molecular Property PredictiononMUV
ROC-AUC
69.47
best: 99.8 (Deep-CBN)
Molecular Property PredictiononSIDER
ROC-AUC
91.11
Molecular Property PredictiononTox21
ROC-AUC
89.8
best: 92.4 (Deep-CBN)

Medical3 results

Atomistic DescriptiononMUV
ROC-AUC
69.47
best: 99.8 (Deep-CBN)
Atomistic DescriptiononSIDER
ROC-AUC
91.11
Atomistic DescriptiononTox21
ROC-AUC
89.8
best: 92.4 (Deep-CBN)