SchNet-edge-update

Reported on 4 benchmarks across 2 tasks · 1 paper · 4 SOTA

Note: results are matched by exact model name. Different papers may use the same name for different model variants.

Miscellaneous2 results

Formation EnergyonMaterials Project
MAE· 2018-06-08
22.7
best: 17.47 (CartNet)
SOTA
Neural Message Passing with Edge Updates for Predicting Properties of Molecules and Materials arXiv:1806.03146
Formation EnergyonQM9
MAE· 2018-06-08
0.242
best: 0.09 (TensorNet)
SOTA
Neural Message Passing with Edge Updates for Predicting Properties of Molecules and Materials arXiv:1806.03146

Medical2 results

Atomistic DescriptiononMaterials Project
MAE· 2018-06-08
22.7
best: 17.47 (CartNet)
SOTA
Neural Message Passing with Edge Updates for Predicting Properties of Molecules and Materials arXiv:1806.03146
Atomistic DescriptiononQM9
MAE· 2018-06-08
0.242
best: 0.00467 (Uni-Mol)
SOTA
Neural Message Passing with Edge Updates for Predicting Properties of Molecules and Materials arXiv:1806.03146