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Consensus docking affinity score of ligands against two target proteins.
| Target | Ligand | Binding affinity (kcal/mol) |
||
|---|---|---|---|---|
| AutoDock Vina | Mcule | Consensus Docking | ||
| AChE | Donepezil | −8.3 | −8.2 | −8.2 |
| Tinosporide | −8.7 | −9.0 | −8.8 | |
| 8-hydroxytinosporide | −9.0 | −8.7 | −8.8 | |
| BuChE | Donepezil | −9.9 | −9.3 | −9.6 |
| Tinosporide | −8.8 | −9.4 | −9.1 | |
| 8-hydroxytinosporide | −9.5 | −9.9 | −9.7 | |
