BBBP
Benchmarks
Task NameDataset NameSOTA ResultTrendResults
BBBP (test)
0.92ROC-AUC
94
BBBP
0.968ROC AUC
93
BBBP
88.75ROC-AUC
87
BBBP 50-shot (test)
0.581ROC AUC
40
BBBP
0.937ROC-AUC
39
bbbp (test)
11.5Fidelity F1
32
BBBP
73.16Attack Success Rate (ASR)
30
BBBP
84Accuracy
26
BBBP full-shot (test)
70.18ROC-AUC
25
BBBP (test)
0.769AUC-ROC
22
BBBP
100AUC
20
BBBP
73.15ROC-AUC
18
BBBP
0.84MCC
18
BBBP random 6:2:2 (test)
89.46ROC-AUC
17
BBBP 100-shot (test)
56.97ROC-AUC
15
BBBP Target set
0.884F1 Score
14
BBBP
99.73Success Rate (SR)
14
BBBP 5-shot
59.81F1 Score
12
BBBP semi-supervised (test)
68.04F1 Score
12
BBBP
55.26Macro F1
12
BBBP (MoleculeNet) scaffold-split (test)
74.08AUROC (%)
12
BBBP
2.44SA Score
9
BBBP
100Validity
8
BBBP
1Average Minimality Score
8
BBBP
1.5Inference Time (ms)
8