| Paper | Code | Energy MAE | ModelName | ReleaseDate |
|---|---|---|---|---|
| GemNet-OC: Developing Graph Neural Networks for Large and Diverse Molecular Simulation Datasets | 0.348 | GemNet-OC | 2022-04-06 | |
| Towards Training Billion Parameter Graph Neural Networks for Atomic Simulations | ✓ Link | 0.3712 | GemNet-XL | 2022-03-18 |
| Rotation Invariant Graph Neural Networks using Spin Convolutions | ✓ Link | 0.436675 | SpinConv | 2021-06-17 |
| Simple GNN Regularisation for 3D Molecular Property Prediction & Beyond | ✓ Link | 0.47225 | Noisy Nodes | 2021-06-15 |