Table 1.
List of observed average and standard deviations of all energetic components including the binding energy taken from MM-PBSA analysis.
| Complexes | Binding Energy (KJ/mol) |
SASA Energy (KJ/mol) |
Polar Solvation Energy (KJ/mol) |
Electrostatic Energy (KJ/mol) |
Van der Waal Energy (KJ/mol) |
|---|---|---|---|---|---|
| NSP-12/Dasabuvir | −42.151 ± 21.735 | −20.615 ± 1.635 | 228.354 ± 25.854 | −87.631 ± 20.339 | −162.259 ± 16.736 |
| NSP-12/Ribavirin | 60.285 ± 28.431 | −8.846 ± 1.638 | 420.099 ± 75.663 | −327.013 ± 76.448 | −23.956 ± 20.920 |
| NSP-12/Sofosbuvir | −26.168 ± 54.225 | −9.734 ± 5.282 | 94.581 ± 68.246 | −26.753 ± 24.025 | −84.262 ± 47.830 |