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Energy and force prediction on Diels-Alder (out-of-equilibrium)

1.09EnergyMoLe-Λ
-1.639616.785235.2153.6348May 28, 2026

Evaluation results

MethodLinks
MoLe-Λ2026.051.090.24
Mace+MP22026.051.611.43
eSEN+MP22026.051.811.94
Mace2026.0511.257.99
eSEN2026.0516.3912.08
MP22026.0569.331.18