From: Fast, efficient fragment-based coordinate generation for Open Babel
Speed | Time (s) | RMSD (Å) | Bond (Å) | Angle (\(^\circ\)) | Torsion (\(^\circ\)) | TFD | Success (%) |
---|---|---|---|---|---|---|---|
Fastest (No MMFF) | 54.8 | 1.75 | 0.049 | 2.49 | 44.1 | 0.27 | 93.9 |
Fast (100 MMFF) | 372.7 | 1.72 | 0.049 | 2.90 | 44.1 | 0.26 | 93.6 |
Med (200 MMFF + conf. search) | 732.1 | 1.60 | 0.048 | 2.52 | 43.0 | 0.23 | 93.9 |