| RUN | Initial microstate | Final microstate | ΔΔG / kcal M-1 | Work distribution | Convergence | ||||||
|---|---|---|---|---|---|---|---|---|---|---|---|
| RUN4819 | MAT-POS-b3e365b9-1_1 |
|
EN300-23223_3_1_1 |
|
−1.2 ± 0.3 |
|
|
||||
| RUN6301 | MAT-POS-b3e365b9-1_1 |
|
EN300-132624_2_1_1 |
|
−1.2 ± 0.3 |
|
|
||||
| RUN5481 | MAT-POS-b3e365b9-1_1 |
|
EN300-72730_1_2_1 |
|
−1.1 ± 0.2 |
|
|
||||
| RUN4465 | MAT-POS-b3e365b9-1_1 |
|
EN300-6082676_1_1_1 |
|
−1.1 ± 0.3 |
|
|
||||
| RUN5293 | MAT-POS-b3e365b9-1_1 |
|
EN300-55109_1_1_1 |
|
−1.1 ± 0.2 |
|
|
||||
| RUN5201 | MAT-POS-b3e365b9-1_1 |
|
EN300-05512_2_1_1 |
|
−1.1 ± 0.3 |
|
|
||||
| RUN3381 | MAT-POS-b3e365b9-1_1 |
|
EN300-00904_1_1_2 |
|
−1.1 ± 0.3 |
|
|
||||
| RUN6884 | MAT-POS-b3e365b9-1_1 |
|
EN300-94945_3_1_1 |
|
−1.1 ± 0.3 |
|
|
||||
| RUN3858 | MAT-POS-b3e365b9-1_1 |
|
EN300-128463_3_1_1 |
|
−1.1 ± 0.3 |
|
|
||||
| RUN4926 | MAT-POS-b3e365b9-1_1 |
|
EN300-1448603_3_2_1 |
|
−1.1 ± 0.3 |
|
|
||||
| RUN6613 | MAT-POS-b3e365b9-1_1 |
|
EN300-1630093_1_2_1 |
|
−1.1 ± 0.3 |
|
|
||||
| RUN5904 | MAT-POS-b3e365b9-1_1 |
|
EN300-72896_3_1_1 |
|
−1.1 ± 0.3 |
|
|
||||
| RUN3018 | MAT-POS-b3e365b9-1_1 |
|
EN300-211203_1_1_1 |
|
−1.1 ± 0.3 |
|
|
||||
| RUN5780 | MAT-POS-b3e365b9-1_1 |
|
EN300-7473354_1_1_1 |
|
−1.1 ± 0.3 |
|
|
||||
| RUN3982 | MAT-POS-b3e365b9-1_1 |
|
EN300-1718364_1_1_1 |
|
−1.1 ± 0.3 |
|
|
||||
| RUN7140 | MAT-POS-b3e365b9-1_1 |
|
EN300-1605226_1_1_1 |
|
−1.1 ± 0.3 |
|
|
||||
| RUN3594 | MAT-POS-b3e365b9-1_1 |
|
EN300-123614_1_1_1 |
|
−1.1 ± 0.3 |
|
|
||||
| RUN3216 | MAT-POS-b3e365b9-1_1 |
|
EN300-1138792_1_1_1 |
|
−1.1 ± 0.2 |
|
|
||||
| RUN4718 | MAT-POS-b3e365b9-1_1 |
|
EN300-7003350_1_1_1 |
|
−1.1 ± 0.2 |
|
|
||||
| RUN7520 | MAT-POS-b3e365b9-1_1 |
|
EN300-373476_1_2_1 |
|
−1.1 ± 0.3 |
|
|
||||
| RUN4850 | MAT-POS-b3e365b9-1_1 |
|
EN300-158260_1_1_1 |
|
−1.1 ± 0.2 |
|
|
||||
| RUN2458 | MAT-POS-b3e365b9-1_1 |
|
EDJ-MED-d203f206-34_1 |
|
−1.1 ± 0.3 |
|
|
||||
| RUN299 | MAT-POS-b3e365b9-1_1 |
|
PET-UNK-cf04cb02-1_2 |
|
−1.1 ± 0.4 |
|
|
||||
| RUN5095 | MAT-POS-b3e365b9-1_1 |
|
EN300-1654606_1_1_1 |
|
−1.1 ± 0.2 |
|
|
||||
| RUN3607 | MAT-POS-b3e365b9-1_1 |
|
EN300-1253122_2_1_1 |
|
−1.1 ± 0.3 |
|
|
||||
| RUN5942 | MAT-POS-b3e365b9-1_1 |
|
EN300-188356_1_1_1 |
|
−1.1 ± 0.3 |
|
|
||||
| RUN3069 | MAT-POS-b3e365b9-1_1 |
|
EN300-7436306_3_1_2 |
|
−1.1 ± 0.3 |
|
|
||||
| RUN4612 | MAT-POS-b3e365b9-1_1 |
|
EN300-1709410_1_2_1 |
|
−1.1 ± 0.3 |
|
|
||||
| RUN3327 | MAT-POS-b3e365b9-1_1 |
|
EN300-90225_2_1_1 |
|
−1.1 ± 0.2 |
|
|
||||
| RUN5650 | MAT-POS-b3e365b9-1_1 |
|
EN300-7444533_3_4_1 |
|
−1.1 ± 0.4 |
|
|
||||
| RUN3859 | MAT-POS-b3e365b9-1_1 |
|
EN300-748981_3_1_1 |
|
−1.1 ± 0.3 |
|
|
||||
| RUN5248 | MAT-POS-b3e365b9-1_1 |
|
EN300-259694_1_2_1 |
|
−1.1 ± 0.3 |
|
|
||||
| RUN4203 | MAT-POS-b3e365b9-1_1 |
|
EN300-306026_1_1_1 |
|
−1.1 ± 0.2 |
|
|
||||
| RUN6292 | MAT-POS-b3e365b9-1_1 |
|
EN300-7493296_1_1_1 |
|
−1.1 ± 0.2 |
|
|
||||
| RUN4697 | MAT-POS-b3e365b9-1_1 |
|
EN300-300217_1_2_1 |
|
−1.1 ± 0.3 |
|
|
||||
| RUN4927 | MAT-POS-b3e365b9-1_1 |
|
EN300-124301_3_1_1 |
|
−1.1 ± 0.3 |
|
|
||||
| RUN5858 | MAT-POS-b3e365b9-1_1 |
|
EN300-68747_1_1_1 |
|
−1.1 ± 0.2 |
|
|
||||
| RUN7548 | MAT-POS-b3e365b9-1_1 |
|
EN300-48902_3_2_1 |
|
−1.1 ± 0.4 |
|
|
||||
| RUN7491 | MAT-POS-b3e365b9-1_1 |
|
EN300-25572_1_1_1 |
|
−1.1 ± 0.3 |
|
|
||||
| RUN4329 | MAT-POS-b3e365b9-1_1 |
|
EN300-246992_1_2_1 |
|
−1.1 ± 0.2 |
|
|
||||
| RUN3051 | MAT-POS-b3e365b9-1_1 |
|
EN300-25446_1_1_1 |
|
−1.1 ± 0.2 |
|
|
||||
| RUN5245 | MAT-POS-b3e365b9-1_1 |
|
EN300-19700_2_1_1 |
|
−1.1 ± 0.2 |
|
|
||||
| RUN7008 | MAT-POS-b3e365b9-1_1 |
|
EN300-1725538_1_2_1 |
|
−1.1 ± 0.3 |
|
|
||||
| RUN3699 | MAT-POS-b3e365b9-1_1 |
|
EN300-181938_1_1_1 |
|
−1.1 ± 0.3 |
|
|
||||
| RUN4434 | MAT-POS-b3e365b9-1_1 |
|
EN300-258702_3_1_1 |
|
−1.1 ± 0.3 |
|
|
||||
| RUN5119 | MAT-POS-b3e365b9-1_1 |
|
EN300-123489_1_1_1 |
|
−1.1 ± 0.2 |
|
|
||||
| RUN6764 | MAT-POS-b3e365b9-1_1 |
|
EN300-393148_1_1_1 |
|
−1.1 ± 0.3 |
|
|
||||