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Binding scores for virtual screening with PyRx 2NOS
| S. no | Ligand | Protein | MolDock | ReRank | Hbond |
|---|---|---|---|---|---|
| 1 | Compound 1 | 1OUK | – 85.494 | – 76.258 | 000 |
| 2 | Compound 2 | 1OUK | – 89.548 | – 81.685 | – 1.943 |
| 3 | Compound 3 | 1OUK | – 94.926 | – 80.559 | – 2.500 |
| 4 | SB203580 | 1OUK | – 136.343 | – 115.795 | – 0.509 |
