TDC.Half_Life_Obach Leaderboard
Dataset Summary
| Dataset | Unit | Size | Task | Metric | Dataset Split |
|---|---|---|---|---|---|
| TDC.Half_Life_Obach | hr | 667 | Regression | Spearman | Scaffold |
Leaderboard
| Rank | Model | Contact | Link | #Params | Spearman |
|---|---|---|---|---|---|
| 1 | CNN (DeepPurpose) | Kexin Huang | GitHub, Paper | 226,625 | 0.038 ± 0.138 |
| 2 | RDKit2D + MLP (DeepPurpose) | Kexin Huang | GitHub, Paper | 633,409 | 0.184 ± 0.111 |
| 3 | Morgan + MLP (DeepPurpose) | Kexin Huang | GitHub, Paper | 1,477,185 | 0.329 ± 0.083 |
: The higher the better.