Table 2.
The binding energy of different anti-HIV drugs and J. adhatoda alkaloids with Mpro.
| Drug | Binding energy (kcal/mol) |
|---|---|
| Darunavir | -7.4 |
| Lopinavir | -7.3 |
| Vasicoline | -6.7 |
| Vasicolinone | -6.9 |
| Vasicinone | -5.8 |
| Vasicine | -5.5 |
| Adhatodine | -6.9 |
| Anisotine | -7.9 |
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