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Benchmarks
Molecular Interaction Prediction on CombiSolv Chromophore
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22.36
RMSE
DisTrans
21.962
24.6485
27.335
30.0215
May 16, 2026
RMSE
Updated 15d ago
Evaluation Results
Method
Method
Links
RMSE
DisTrans
Transfer Ratio=70%
2026.05
22.36
CausalGIB
2026.05
22.95
IGIB-ISE
2026.05
23.83
DisTrans
Transfer Ratio=50%
2026.05
23.85
CMRL
2026.05
24.3
DisTrans
Transfer Ratio=30%
2026.05
24.66
CGIB
2026.05
24.9
CIGIN
2026.05
25.09
MMGNN
2026.05
25.33
MIRACLE
2026.05
25.75
Meta-MolNet
2026.05
25.95
BIT
2026.05
26.35
MPNN
2026.05
30.17
GAT
2026.05
30.9
GCN
2026.05
31.87
GINE
2026.05
32.31
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