Table 6.
Mulliken atomic charges of the atoms involved in hydrogen bonds.
| Compound name | Ligand atoms | Mulliken atomic charges (au) |
|---|---|---|
| Reference | O2 | −0.449 |
| Lonafarnib | O5 | −0.527 |
| N8 | −0.303 | |
| Hit 1 | O24 | −0.448 |
| Hit 2 | O10 | −0.437 |
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