Regression on FreeSolv (scaffold)
1.877RMSEGEM
Evaluation Results
| Method | Links | |
|---|---|---|
| GEMSplit=scaffold2023.04 | 1.877 | |
| SYN-FUSION MolCLRMolecules=642, Tasks=12023.08 | 2.08 | |
| D-MPNNSplit=scaffold2023.04 | 2.082 | |
| RFMolecules=642, Tasks=12023.08 | 2.1 | |
| KPGTSplit=scaffold2023.04 | 2.121 | |
| D-MPNNMolecules=642, Tasks=12023.08 | 2.18 | |
| MolCLRSplit=scaffold2023.04 | 2.2 | |
| GINMolecules=642, Tasks=12023.08 | 2.76 | |
| GINSplit=scaffold2023.04 | 2.76 | |
| SELFormerSplit=scaffold2023.04 | 2.797 | |
| MolCLR_GINMolecules=642, Tasks=12023.08 | 2.81 | |
| Hu et al.Molecules=642, Tasks=12023.08 | 2.83 | |
| Hu et al.Split=scaffold2023.04 | 2.83 | |
| GCNMolecules=642, Tasks=12023.08 | 2.87 | |
| GCNSplit=scaffold2023.04 | 2.87 | |
| SYN-FUSION Hu et. alMolecules=642, Tasks=12023.08 | 3.13 | |
| SVMMolecules=642, Tasks=12023.08 | 3.14 | |
| SchNetSplit=scaffold2023.04 | 3.22 | |
| MGCNSplit=scaffold2023.04 | 3.35 |