Table 2 Molecular dynamics simulation results.
From: Partridge and embryonated partridge egg as new preclinical models for candidiasis
Bcl-2 family | Virulence factors | LJ (kJ/mol) | Coul (kJ/mol) | SASA (nm2) | NHB | Density (kg m−3) |
|---|---|---|---|---|---|---|
Bcl-2 | ASP | − 589.92 | − 985.23 | 288.66 | 26.66 | 1005.11 |
Bcl-2 | PAO | − 1265.08 | − 1722.55 | 360.71 | 37.94 | 1005.93 |
Bcl-2 | TRY | − 57.32 | − 42.71 | 120.68 | 0.99 | 1020.46 |
Bax | ASP | − 505.32 | − 839.19 | 280.85 | 24.21 | 1015.24 |
Bax | PAO | − 1281.96 | − 1673.63 | 357.00 | 41.90 | 1013.41 |
Bax | TRY | − 63.48 | − 50.64 | 114.55 | 1.07 | 1025.48 |
