| RUN | Initial microstate | Final microstate | ΔΔG / kcal M-1 | Work distribution | Convergence | ||||||
|---|---|---|---|---|---|---|---|---|---|---|---|
| RUN702 | ADA-UCB-6c2cb422-1_1 |
|
PET-UNK-7f7e354d-7_1 |
|
0.31 ± 0.08 |
|
|
||||
| RUN569 | ADA-UCB-6c2cb422-1_1 |
|
EDJ-MED-ee07cf00-8_2 |
|
0.5 ± 0.2 |
|
|
||||
| RUN143 | ADA-UCB-6c2cb422-1_1 |
|
SAM-UNK-2684b532-13_1 |
|
0.61 ± 0.08 |
|
|
||||
| RUN40 | ADA-UCB-6c2cb422-1_1 |
|
ALP-POS-95b75b4d-8_1 |
|
0.90 ± 0.08 |
|
|
||||