Table 1.
Protein | Compound | Pose | ‐PLP1 | ‐PLP2 | ‐PMF |
---|---|---|---|---|---|
VEGFR‐2 | Jzu 17 | 1 | 70.61 | 71.31 | 78.35 |
VEGF‐A | Jzu 17 | 1 | 56.81 | 51.74 | 44.71 |
Jzu 17 | 2 | 62.32 | 54.81 | 43.99 | |
Jzu 17 | 3 | 72.09 | 68.08 | 48.22 |
Note. Triple consensus scoring: PLP1, PLP2, and PMF.
Abbreviations: PLP, piecewise linear potential; PMF, potential of mean force.