ResearchBenchmarksEnergy and Force Prediction on Revised MD17 Toluene (test)Follow0.3EnergyTensorNet0.2920.3460.40.454Jun 10, 2023Evaluation ResultsMethodMethodLinksEnergyForceTensorNetLayers=1L, Parameters=...Layers=1L, Parameters=535k2023.060.32TensorNetLayers=2L, Parameters=...Layers=2L, Parameters=770k2023.060.31.7NequIP2023.060.31.6Allegro2023.060.41.8BOTNet2023.060.41.9MACE2023.060.51.5