Table 2 gmx_MMPBSA analysis. According to the gmx_MMPBSA analysis, the table shows that the cIAP1 and NAIP have the highest binding affinity to the Survivin protein. The values represent averages from 80 to 100 ns during the MD simulation.
From: Restoring apoptosis in breast cancer via peptide mediated disruption of survivin IAP interaction
Energy (KJ/mol) | ||||
|---|---|---|---|---|
System | Total interaction | Van der Waals | Electrostatic | Desolvation |
cIAP1–Survivin | \(-51.87\) | \(-75.58\) | -608.87 | \(632.58\) |
NAIP–Survivin | \(-47.64\) | \(-65.41\) | -97.37 | \(115.14\) |
