Our new X account is live! Follow @wizwand_team for updates
Home
/
Benchmarks
Energy and force prediction on MD17 Naphtalene (test)
Loading...
0.11
Energy MAE (kcal/mol)
SchNet
-0.0288
0.9081
1.845
2.7819
Jun 26, 2017
Energy MAE (kcal/mol)
Force MAE (kcal/mol/Å)
Updated 4d ago
Evaluation Results
Method
Method
Links
Energy MAE (kcal/mol)
Force MAE (kcal/mol/Å)
SchNet
Training Examples (N)=...
2017.06
0.11
0.11
GDML
Training Examples (N)=...
2017.06
0.12
0.23
SchNet
Training Examples (N)=...
2017.06
0.16
0.58
SchNet
Training Examples (N)=...
2017.06
0.2
-
SchNet
Training Examples (N)=...
2017.06
3.58
25.36
Feedback
Search any
task
Search any
task