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Molecular Property Prediction on 3BPA 600 K v1 (test)
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9.7
Energy RMSE
MACE
9.54
10.62
11.7
12.78
Jun 15, 2022
Energy RMSE
Force RMSE
Updated 4d ago
Evaluation Results
Method
Method
Links
Energy RMSE
Force RMSE
MACE
L (Equivariant Order)=...
2022.06
9.7
21.8
MACE
L (Equivariant Order)=...
2022.06
9.9
24.6
NequIP
L (Equivariant Order)=...
2022.06
11.2
26.4
NequIP
L (Equivariant Order)=...
2022.06
11.3
27.3
BOTNet
L (Equivariant Order)=...
2022.06
11.5
26.7
Allegro
L (Equivariant Order)=...
2022.06
12.07
29.17
MACE
L (Equivariant Order)=...
2022.06
13.7
33.3
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