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Benchmarks
Aqueous solubility prediction on BigSolDB2
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1.21
Mean MAE
MPNN+MLP
1.2028
1.2514
1.3
1.3486
Jul 2, 2026
Mean MAE
Standard Deviation of MAE
Median MAE
Updated 23d ago
Evaluation Results
Method
Method
Links
Mean MAE
Standard Deviation of MAE
Median MAE
MPNN+MLP
Architecture=Message P...
2026.07
1.21
0.19
1.21
GCN+MLP
Architecture=Graph Con...
2026.07
1.24
0.12
1.27
GCN
Architecture=Baseline...
2026.07
1.29
0.05
1.28
GCN+MLP with interaction
Architecture=GCN+MLP w...
2026.07
1.39
0.12
1.41
MPNN+MLP with interaction
Architecture=MPNN+MLP...
2026.07
1.39
0.21
1.38
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