| RUN | Atom map | Initial microstate | Final microstate | ΔΔGcalc / kcal M-1 | ΔΔGexp / kcal M-1 | |ΔΔG-ΔΔGexp| / kcal M-1 | Work distribution | Bootstrapping | Convergence | ||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| RUN1033 | VLA-UCB-50c39ae8-2_1 |
|
VLA-UCB-50c39ae8-2_1 |
|
−0.02 ± 0.05 | 0.00 ± 0.05 | 0.02 ± 0.07 |
|
|
|
|||
