Molecular property prediction: predict whether a molecule inhibits HIV replication. 41K graphs from MoleculeNet. Binary classification, scaffold split, evaluated by ROC-AUC.
Roc Auc is the reported evaluation metric for OGB ogbg-molhiv. Codesota tracks published model scores on this metric so readers can compare state-of-the-art results across sources and model families.
Higher is better
| Rank | Model | Trust | Score | Year | Links | Fix |
|---|---|---|---|---|---|---|
| 01 | DGN | paper | 79.7 | 2026 | Source ↗ | Looks wrong? |
| 02 | GraphGPS | paper | 78.8 | 2026 | Source ↗ | Looks wrong? |
| 03 | GIN+virtual node | paper | 77.07 | 2026 | Source ↗ | Looks wrong? |