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Energy and Force Prediction on rMD17 Uracil (test)

0.4Energy (E)TensorNet
0.3920.4460.50.554Jun 10, 2023

Evaluation results

MethodLinks
TensorNetLayers=2L, Parameters=770k2023.060.43.1
NequIP2023.060.43.1
BOTNet2023.060.43.2
TensorNetLayers=1L, Parameters=535k2023.060.53.6
MACE2023.060.52.1
Allegro2023.060.61.8