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Results of the MM-PBSA calculations of the interaction of peptides 1 and 2 with VEGFR-2a.
| Peptide | ΔEpot (kcal/mol) | ΔG°PB(kcal/mol) | ΔSAS (nm2) | ΔG°binding (kcal/mol) |
|---|---|---|---|---|
| 1 | −32 ± 1 | 26 ± 1 | −3.59 ± 0.02 | −8 ± 2 |
| 2 | −39 ± 1 | 27 ± 1 | −4.42 ± 0.02 | −14 ± 2 |
The various terms are described in the Methods section.
