LUMO Property Prediction on QM9 (test)
0.146RMSEESA
Evaluation Results
| Method | Links | |
|---|---|---|
| ESAStrategy=Transductive2024.02 | 0.146 | |
| GraphormerStrategy=Transductive2024.02 | 0.147 | |
| ESAStrategy=Inductive2024.02 | 0.15 | |
| GraphormerStrategy=Inductive2024.02 | 0.151 | |
| GATStrategy=Transductive2024.02 | 0.153 | |
| GATV2Strategy=Transductive2024.02 | 0.153 | |
| PNAStrategy=Transductive2024.02 | 0.153 | |
| GATStrategy=Inductive2024.02 | 0.156 | |
| PNAStrategy=Inductive2024.02 | 0.156 | |
| TokenGTStrategy=Transductive2024.02 | 0.156 | |
| GATV2Strategy=Inductive2024.02 | 0.157 | |
| DropGINStrategy=Transductive2024.02 | 0.157 | |
| DropGINStrategy=Inductive2024.02 | 0.159 | |
| TokenGTStrategy=Inductive2024.02 | 0.165 | |
| GraphGPSStrategy=Inductive2024.02 | 0.167 | |
| GraphGPSStrategy=Transductive2024.02 | 0.169 | |
| PNAStrategy=GW (no transfer learning)2024.02 | 0.174 | |
| ESAStrategy=GW (no transfer learning)2024.02 | 0.174 | |
| GATV2Strategy=GW (no transfer learning)2024.02 | 0.178 | |
| GraphGPSStrategy=GW (no transfer learning)2024.02 | 0.178 | |
| DropGINStrategy=GW (no transfer learning)2024.02 | 0.18 | |
| GATStrategy=GW (no transfer learning)2024.02 | 0.181 | |
| GraphormerStrategy=GW (no transfer learning)2024.02 | 0.19 | |
| TokenGTStrategy=GW (no transfer learning)2024.02 | 0.204 |