| RUN | Initial microstate | Final microstate | ΔΔG / kcal M-1 | Work distribution | Convergence | ||||||
|---|---|---|---|---|---|---|---|---|---|---|---|
| RUN8000 | MAT-POS-8a69d52e-7_1 |
|
EN300-1071940_1_1 |
|
−0.5 ± 0.2 |
|
|
||||
| RUN4593 | MAT-POS-8a69d52e-7_1 |
|
EN300-74856_1_1 |
|
−0.5 ± 0.3 |
|
|
||||
| RUN8079 | MAT-POS-8a69d52e-7_1 |
|
EN300-109827_1_2 |
|
−0.5 ± 0.2 |
|
|
||||
| RUN2699 | MAT-POS-8a69d52e-7_1 |
|
EN300-1664603_3_1 |
|
−0.5 ± 0.3 |
|
|
||||
| RUN2642 | MAT-POS-8a69d52e-7_1 |
|
EN300-105267_2_1 |
|
−0.5 ± 0.3 |
|
|
||||
| RUN14304 | MAT-POS-8a69d52e-7_1 |
|
EN300-396372_1_2 |
|
−0.5 ± 0.3 |
|
|
||||
| RUN721 | MAT-POS-8a69d52e-7_1 |
|
EN300-69368_3_1 |
|
−0.5 ± 0.3 |
|
|
||||
| RUN2562 | MAT-POS-8a69d52e-7_1 |
|
EN300-37195_2_1 |
|
−0.5 ± 0.3 |
|
|
||||
| RUN11443 | MAT-POS-8a69d52e-7_1 |
|
EN300-30536_1_1 |
|
−0.5 ± 0.2 |
|
|
||||
| RUN5725 | MAT-POS-8a69d52e-7_1 |
|
EN300-6746326_1_1 |
|
−0.5 ± 0.2 |
|
|
||||
| RUN12014 | MAT-POS-8a69d52e-7_1 |
|
EN300-223187_3_1 |
|
−0.5 ± 0.3 |
|
|
||||
| RUN8931 | MAT-POS-8a69d52e-7_1 |
|
EN300-1452069_4_1 |
|
−0.5 ± 0.4 |
|
|
||||
| RUN6332 | MAT-POS-8a69d52e-7_1 |
|
EN300-7370063_1_1 |
|
−0.5 ± 0.2 |
|
|
||||
| RUN2426 | MAT-POS-8a69d52e-7_1 |
|
EN300-256798_1_1 |
|
−0.5 ± 0.3 |
|
|
||||
| RUN3447 | MAT-POS-8a69d52e-7_1 |
|
EN300-211158_2_1 |
|
−0.5 ± 0.3 |
|
|
||||
| RUN15238 | MAT-POS-8a69d52e-7_1 |
|
EN300-7456948_3_1 |
|
−0.5 ± 0.3 |
|
|
||||
| RUN6341 | MAT-POS-8a69d52e-7_1 |
|
EN300-1440321_1_1 |
|
−0.5 ± 0.3 |
|
|
||||
| RUN741 | MAT-POS-8a69d52e-7_1 |
|
EN300-861925_4_1 |
|
−0.5 ± 0.2 |
|
|
||||
| RUN11073 | MAT-POS-8a69d52e-7_1 |
|
EN300-7431964_2_1 |
|
−0.5 ± 0.2 |
|
|
||||
| RUN3077 | MAT-POS-8a69d52e-7_1 |
|
EN300-6493892_1_1 |
|
−0.5 ± 0.2 |
|
|
||||
| RUN15258 | MAT-POS-8a69d52e-7_1 |
|
EN300-333468_3_1 |
|
−0.5 ± 0.3 |
|
|
||||
| RUN2104 | MAT-POS-8a69d52e-7_1 |
|
EN300-01527_2_1 |
|
−0.5 ± 0.3 |
|
|
||||
| RUN11751 | MAT-POS-8a69d52e-7_1 |
|
EN300-204507_1_1 |
|
−0.5 ± 0.3 |
|
|
||||
| RUN8207 | MAT-POS-8a69d52e-7_1 |
|
EN300-6746622_1_1 |
|
−0.5 ± 0.2 |
|
|
||||
| RUN996 | MAT-POS-8a69d52e-7_1 |
|
EN300-77092_4_1 |
|
−0.5 ± 0.2 |
|
|
||||
| RUN4109 | MAT-POS-8a69d52e-7_1 |
|
EN300-205486_3_1 |
|
−0.5 ± 0.3 |
|
|
||||
| RUN3648 | MAT-POS-8a69d52e-7_1 |
|
EN300-741926_2_3 |
|
−0.5 ± 0.3 |
|
|
||||
| RUN8527 | MAT-POS-8a69d52e-7_1 |
|
EN300-181558_3_1 |
|
−0.5 ± 0.3 |
|
|
||||
| RUN10580 | MAT-POS-8a69d52e-7_1 |
|
EN300-28871_4_1 |
|
−0.5 ± 0.2 |
|
|
||||
| RUN172 | MAT-POS-8a69d52e-7_1 |
|
DAR-DIA-23e5a6a0-7_2 |
|
−0.5 ± 0.3 |
|
|
||||
| RUN7853 | MAT-POS-8a69d52e-7_1 |
|
EN300-24419_2_1 |
|
−0.5 ± 0.3 |
|
|
||||
| RUN2434 | MAT-POS-8a69d52e-7_1 |
|
EN300-331993_3_1 |
|
−0.5 ± 0.2 |
|
|
||||
| RUN6272 | MAT-POS-8a69d52e-7_1 |
|
EN300-124652_1_2 |
|
−0.5 ± 0.3 |
|
|
||||
| RUN90 | MAT-POS-8a69d52e-7_1 |
|
MAK-UNK-8be7dca9-7_1 |
|
−0.5 ± 0.1 |
|
|
||||
| RUN7489 | MAT-POS-8a69d52e-7_1 |
|
EN300-131572_2_1 |
|
−0.5 ± 0.2 |
|
|
||||
| RUN14682 | MAT-POS-8a69d52e-7_1 |
|
EN300-208993_1_1 |
|
−0.5 ± 0.3 |
|
|
||||
| RUN9296 | MAT-POS-8a69d52e-7_1 |
|
EN300-1178209_1_1 |
|
−0.5 ± 0.2 |
|
|
||||
| RUN8663 | MAT-POS-8a69d52e-7_1 |
|
EN300-101373_2_2 |
|
−0.5 ± 0.3 |
|
|
||||
| RUN2833 | MAT-POS-8a69d52e-7_1 |
|
EN300-373552_2_1 |
|
−0.5 ± 0.2 |
|
|
||||
| RUN6919 | MAT-POS-8a69d52e-7_1 |
|
EN300-331476_1_1 |
|
−0.5 ± 0.2 |
|
|
||||
| RUN11649 | MAT-POS-8a69d52e-7_1 |
|
EN300-6480951_1_2 |
|
−0.5 ± 0.2 |
|
|
||||
| RUN9190 | MAT-POS-8a69d52e-7_1 |
|
EN300-120569_2_1 |
|
−0.5 ± 0.3 |
|
|
||||
| RUN5449 | MAT-POS-8a69d52e-7_1 |
|
EN300-154332_1_1 |
|
−0.5 ± 0.2 |
|
|
||||
| RUN69 | MAT-POS-8a69d52e-7_1 |
|
DAR-DIA-6a508060-10_1 |
|
−0.48 ± 0.09 |
|
|
||||
| RUN11545 | MAT-POS-8a69d52e-7_1 |
|
EN300-49064_1_1 |
|
−0.5 ± 0.2 |
|
|
||||
| RUN3101 | MAT-POS-8a69d52e-7_1 |
|
EN300-7353973_1_2 |
|
−0.5 ± 0.3 |
|
|
||||
| RUN10930 | MAT-POS-8a69d52e-7_1 |
|
EN300-244100_1_2 |
|
−0.5 ± 0.2 |
|
|
||||
| RUN13720 | MAT-POS-8a69d52e-7_1 |
|
EN300-213215_1_2 |
|
−0.5 ± 0.3 |
|
|
||||
| RUN3848 | MAT-POS-8a69d52e-7_1 |
|
EN300-98429_2_1 |
|
−0.5 ± 0.3 |
|
|
||||
| RUN165 | MAT-POS-8a69d52e-7_1 |
|
MAK-UNK-8be7dca9-6_2 |
|
−0.5 ± 0.2 |
|
|
||||
| RUN14258 | MAT-POS-8a69d52e-7_1 |
|
EN300-132141_1_1 |
|
−0.5 ± 0.3 |
|
|
||||
| RUN1371 | MAT-POS-8a69d52e-7_1 |
|
EN300-203293_4_2 |
|
−0.5 ± 0.2 |
|
|
||||
| RUN1634 | MAT-POS-8a69d52e-7_1 |
|
EN300-92031_2_1 |
|
−0.5 ± 0.2 |
|
|
||||
| RUN15113 | MAT-POS-8a69d52e-7_1 |
|
EN300-135182_3_1 |
|
−0.5 ± 0.3 |
|
|
||||
| RUN73 | MAT-POS-8a69d52e-7_1 |
|
DAR-DIA-0d514e7d-3_1 |
|
−0.47 ± 0.08 |
|
|
||||
| RUN8451 | MAT-POS-8a69d52e-7_1 |
|
EN300-6733137_1_1 |
|
−0.5 ± 0.3 |
|
|
||||
| RUN3609 | MAT-POS-8a69d52e-7_1 |
|
EN300-6494361_1_1 |
|
−0.5 ± 0.2 |
|
|
||||
| RUN5791 | MAT-POS-8a69d52e-7_1 |
|
EN300-1654606_2_1 |
|
−0.5 ± 0.2 |
|
|
||||
| RUN7385 | MAT-POS-8a69d52e-7_1 |
|
EN300-294602_2_1 |
|
−0.5 ± 0.3 |
|
|
||||
| RUN14468 | MAT-POS-8a69d52e-7_1 |
|
EN300-144606_3_1 |
|
−0.5 ± 0.3 |
|
|
||||
| RUN11775 | MAT-POS-8a69d52e-7_1 |
|
EN300-716218_1_1 |
|
−0.5 ± 0.3 |
|
|
||||
| RUN4347 | MAT-POS-8a69d52e-7_1 |
|
EN300-82179_2_1 |
|
−0.5 ± 0.2 |
|
|
||||
| RUN7710 | MAT-POS-8a69d52e-7_1 |
|
EN300-97300_4_2 |
|
−0.5 ± 0.2 |
|
|
||||
| RUN4305 | MAT-POS-8a69d52e-7_1 |
|
EN300-254105_1_3 |
|
−0.5 ± 0.3 |
|
|
||||
| RUN13054 | MAT-POS-8a69d52e-7_1 |
|
EN300-219427_1_1 |
|
−0.5 ± 0.3 |
|
|
||||
| RUN6181 | MAT-POS-8a69d52e-7_1 |
|
EN300-264318_1_1 |
|
−0.5 ± 0.3 |
|
|
||||
| RUN2337 | MAT-POS-8a69d52e-7_1 |
|
EN300-6762327_1_1 |
|
−0.5 ± 0.3 |
|
|
||||
| RUN3091 | MAT-POS-8a69d52e-7_1 |
|
EN300-1644723_2_4 |
|
−0.5 ± 0.2 |
|
|
||||
| RUN2333 | MAT-POS-8a69d52e-7_1 |
|
EN300-1448603_1_1 |
|
−0.5 ± 0.3 |
|
|
||||
| RUN11343 | MAT-POS-8a69d52e-7_1 |
|
EN300-90531_1_2 |
|
−0.5 ± 0.3 |
|
|
||||
| RUN12716 | MAT-POS-8a69d52e-7_1 |
|
EN300-189729_1_1 |
|
−0.5 ± 0.2 |
|
|
||||
| RUN762 | MAT-POS-8a69d52e-7_1 |
|
EN300-7456499_3_1 |
|
−0.5 ± 0.4 |
|
|
||||
| RUN8856 | MAT-POS-8a69d52e-7_1 |
|
EN300-3451857_3_2 |
|
−0.5 ± 0.3 |
|
|
||||
| RUN8411 | MAT-POS-8a69d52e-7_1 |
|
EN300-151423_3_1 |
|
−0.5 ± 0.3 |
|
|
||||
| RUN15162 | MAT-POS-8a69d52e-7_1 |
|
EN300-702756_3_1 |
|
−0.5 ± 0.3 |
|
|
||||
| RUN915 | MAT-POS-8a69d52e-7_1 |
|
EN300-14006_1_2 |
|
−0.5 ± 0.3 |
|
|
||||
| RUN15524 | MAT-POS-8a69d52e-7_1 |
|
EN300-95507_3_1 |
|
−0.5 ± 0.2 |
|
|
||||
| RUN5259 | MAT-POS-8a69d52e-7_1 |
|
EN300-104395_2_1 |
|
−0.5 ± 0.2 |
|
|
||||
| RUN9656 | MAT-POS-8a69d52e-7_1 |
|
EN300-67191_4_1 |
|
−0.5 ± 0.3 |
|
|
||||
| RUN14294 | MAT-POS-8a69d52e-7_1 |
|
EN300-113218_3_1 |
|
−0.5 ± 0.3 |
|
|
||||
| RUN4296 | MAT-POS-8a69d52e-7_1 |
|
EN300-139846_2_1 |
|
−0.5 ± 0.3 |
|
|
||||
| RUN1587 | MAT-POS-8a69d52e-7_1 |
|
EN300-226314_4_2 |
|
−0.5 ± 0.3 |
|
|
||||
| RUN1662 | MAT-POS-8a69d52e-7_1 |
|
EN300-254105_2_2 |
|
−0.5 ± 0.3 |
|
|
||||
| RUN2355 | MAT-POS-8a69d52e-7_1 |
|
EN300-251396_2_2 |
|
−0.4 ± 0.4 |
|
|
||||
| RUN15318 | MAT-POS-8a69d52e-7_1 |
|
EN300-1428805_3_1 |
|
−0.4 ± 0.3 |
|
|
||||
| RUN5317 | MAT-POS-8a69d52e-7_1 |
|
EN300-6489696_1_1 |
|
−0.4 ± 0.3 |
|
|
||||
| RUN1562 | MAT-POS-8a69d52e-7_1 |
|
EN300-22879_2_1 |
|
−0.4 ± 0.3 |
|
|
||||
| RUN10906 | MAT-POS-8a69d52e-7_1 |
|
EN300-31969_3_1 |
|
−0.4 ± 0.3 |
|
|
||||
| RUN12603 | MAT-POS-8a69d52e-7_1 |
|
EN300-108022_2_1 |
|
−0.4 ± 0.3 |
|
|
||||
| RUN2959 | MAT-POS-8a69d52e-7_1 |
|
EN300-3710141_2_2 |
|
−0.4 ± 0.2 |
|
|
||||
| RUN13724 | MAT-POS-8a69d52e-7_1 |
|
EN300-343474_3_2 |
|
−0.4 ± 0.3 |
|
|
||||
| RUN12734 | MAT-POS-8a69d52e-7_1 |
|
EN300-743350_1_1 |
|
−0.4 ± 0.3 |
|
|
||||
| RUN5617 | MAT-POS-8a69d52e-7_1 |
|
EN300-16772_1_1 |
|
−0.4 ± 0.2 |
|
|
||||
| RUN2858 | MAT-POS-8a69d52e-7_1 |
|
EN300-301925_2_2 |
|
−0.4 ± 0.3 |
|
|
||||
| RUN15463 | MAT-POS-8a69d52e-7_1 |
|
EN300-7237143_1_1 |
|
−0.4 ± 0.2 |
|
|
||||
| RUN4073 | MAT-POS-8a69d52e-7_1 |
|
EN300-364612_1_1 |
|
−0.4 ± 0.3 |
|
|
||||
| RUN13188 | MAT-POS-8a69d52e-7_1 |
|
EN300-198633_3_2 |
|
−0.4 ± 0.3 |
|
|
||||
| RUN13476 | MAT-POS-8a69d52e-7_1 |
|
EN300-129384_1_2 |
|
−0.4 ± 0.2 |
|
|
||||
| RUN9804 | MAT-POS-8a69d52e-7_1 |
|
EN300-7470948_1_1 |
|
−0.4 ± 0.3 |
|
|
||||
| RUN256 | MAT-POS-8a69d52e-7_1 |
|
EN300-99653_2_1 |
|
−0.4 ± 0.3 |
|
|
||||