Ring puckering on Ring Puckering Relaxed with MMFF
0.13Precision AMR (Å)PuckerFlow
Evaluation results
| Method | Links | ||||
|---|---|---|---|---|---|
| PuckerFlowRelaxation protocol=MMFF, Coverage threshold=0.1 Å2026.01 | 0.13 | 70.8 | 0.11 | 72.2 | |
| MCFRelaxation protocol=MMFF, Coverage threshold=0.1 Å2026.01 | 0.14 | 64.3 | 0.11 | 68.1 | |
| RDKit ETKDG (Small Cycles)Relaxation protocol=MMFF, Coverage threshold=0.1 Å2026.01 | 0.15 | 63.4 | 0.12 | 65.5 | |
| RDKit ETKDGRelaxation protocol=MMFF, Coverage threshold=0.1 Å2026.01 | 0.15 | 61 | 0.13 | 63.7 | |
| RDKit KDGRelaxation protocol=MMFF, Coverage threshold=0.1 Å2026.01 | 0.15 | 60.3 | 0.13 | 64 | |
| GeoDiffRelaxation protocol=MMFF, Coverage threshold=0.1 Å2026.01 | 0.17 | 57.2 | 0.14 | 61.4 |