Table 2.
Binding free energy, ΔG (kcal/mol).
| Antibacterial | Antimalarial | ||
|---|---|---|---|
| S/N | Compound code | 5MMN: ΔG (kcal/mol) Scoring function: London dG | 1SME: ΔG (kcal/mol) Scoring function: London dG |
| 1 | 8a | −6.57 | −7.73 |
| 2 | 8b | −6.45 | −7.69 |
| 3 | 8c | −6.71 | −7.80 |
| 4 | 8d | −7.10 | −7.01 |
| 5 | 8e | −6.05 | −8.71 |
| 6 | 8f | −5.74 | −7.75 |
| 7 | 8g | −6.31 | −7.44 |
| 8 | 8h | −6.04 | −7.45 |
| 9 | 8i | −6.70 | −8.27 |
| 10 | 8j | −6.66 | −7.06 |
| 11 | Standard drugs | −5.38 | −6.11 |