Graph Regression
The regression task is similar to graph classification but using different loss function and performance metric.
Papers
Showing 1–10 of 145 papers
All datasetsZINC-500kZINCPCQM4Mv2-LSCLipophilicityPCQM4M-LSCPeptides-structZINC 100kTox21ZINC-fullESOLQM9QM9: del e
Benchmark Results
| # | Model | Metric | Claimed | Verified | Status |
|---|---|---|---|---|---|
| 1 | CKGCN | MAE | 5.9 | — | Unverified |
| 2 | GIN | MAE | 0.53 | — | Unverified |
| 3 | GraphSage | MAE | 0.4 | — | Unverified |
| 4 | RingGNN | MAE | 0.35 | — | Unverified |
| 5 | 3WLGNN | MAE | 0.3 | — | Unverified |
| 6 | MoNet | MAE | 0.29 | — | Unverified |
| 7 | GatedGCN | MAE | 0.28 | — | Unverified |
| 8 | MPNN (max) | MAE | 0.25 | — | Unverified |
| 9 | GatedGCN-E-PE | MAE | 0.21 | — | Unverified |
| 10 | GatedGCN-PE | MAE | 0.21 | — | Unverified |