Protein-Ligand Affinity Prediction 벤치마크
Protein-Ligand Affinity Prediction on CSAR-HiQ
RMSE 낮을수록 좋음
- 2022-05-14 — LightGBM: RMSE 1.725
- 2024-02-08 — PLAPT: RMSE 1.349
- 2024-11-06 — BAPULM: RMSE 1.328
| Rank | Model | RMSE | Paper | Code | Year |
|---|---|---|---|---|---|
| 1 | BAPULM | 1.328±0.02 | BAPULM: Binding Affinity Prediction using Language Models | radh55sh/BAPULM | 2024 |
| 2 | PLAPT | 1.349 | PLAPT: Protein-Ligand Binding Affinity Prediction Using Pretrained Transformers | trrt-good/WELP-PLAPT | 2024 |
| 3 | LightGBM | 1.725 | High Performance of Gradient Boosting in Binding Affinity Prediction | 2022 |