Adsorbate placement on OC20-Dense 44 systems (ID)
34.1SR@1AdsorbFlow
Evaluation results
| Method | Links | |||||
|---|---|---|---|---|---|---|
| AdsorbFlowBackbone=EqV2, Steps=5, Guidance scale (w)=72026.02 | 34.1 | 45.5 | 54.5 | 61.4 | 6.8 | |
| AdsorbDiffBackbone=EqV2, Steps=~1002026.02 | 31.8 | 34.1 | 36.3 | 41 | 13.6 | |
| AdsorbFlowBackbone=PaiNN, Steps=5, Guidance scale (w)=52026.02 | 27.3 | 34.1 | 45.5 | 47.7 | 13.6 | |
| AdsorbMLBackbone=N/A, Steps=N/A2026.02 | 9.1 | 20.5 | 34.1 | 47.7 | 6.8 |