| RUN | Initial microstate | Final microstate | ΔΔG / kcal M-1 | Work distribution | Convergence | ||||||
|---|---|---|---|---|---|---|---|---|---|---|---|
| RUN147 | MAT-POS-b3e365b9-1_1 |
|
VLA-UCB-50c39ae8-7_1 |
|
−1.6 ± 0.2 |
|
|
||||
| RUN1174 | MAT-POS-b3e365b9-1_1 |
|
EN300-6736413_2_2 |
|
−1.6 ± 0.2 |
|
|
||||
| RUN600 | MAT-POS-b3e365b9-1_1 |
|
EN300-248526_3_2 |
|
−1.6 ± 0.3 |
|
|
||||
| RUN1128 | MAT-POS-b3e365b9-1_1 |
|
EN300-18249_1_1 |
|
−1.6 ± 0.2 |
|
|
||||
| RUN1639 | MAT-POS-b3e365b9-1_1 |
|
EN300-47606_1_1 |
|
−1.6 ± 0.3 |
|
|
||||
| RUN547 | MAT-POS-b3e365b9-1_1 |
|
EN300-219020_4_1 |
|
−1.6 ± 0.3 |
|
|
||||
| RUN1649 | MAT-POS-b3e365b9-1_1 |
|
EN300-182913_3_1 |
|
−1.6 ± 0.3 |
|
|
||||
| RUN70 | MAT-POS-b3e365b9-1_1 |
|
JOH-SUS-a69c159d-6_1 |
|
−1.63 ± 0.06 |
|
|
||||
| RUN338 | MAT-POS-b3e365b9-1_1 |
|
EN300-207873_1_1 |
|
−1.6 ± 0.2 |
|
|
||||
| RUN330 | MAT-POS-b3e365b9-1_1 |
|
EN300-135060_1_1 |
|
−1.6 ± 0.3 |
|
|
||||
| RUN396 | MAT-POS-b3e365b9-1_1 |
|
EN300-17381_4_2 |
|
−1.6 ± 0.3 |
|
|
||||
| RUN282 | MAT-POS-b3e365b9-1_1 |
|
EN300-12139_1_1 |
|
−1.6 ± 0.4 |
|
|
||||
| RUN1252 | MAT-POS-b3e365b9-1_1 |
|
EN300-1448603_3_2 |
|
−1.6 ± 0.4 |
|
|
||||
| RUN711 | MAT-POS-b3e365b9-1_1 |
|
EN300-02067_3_2 |
|
−1.6 ± 0.3 |
|
|
||||
| RUN1700 | MAT-POS-b3e365b9-1_1 |
|
EN300-78135_1_1 |
|
−1.6 ± 0.2 |
|
|
||||
| RUN284 | MAT-POS-b3e365b9-1_1 |
|
EN300-306316_4_1 |
|
−1.6 ± 0.2 |
|
|
||||
| RUN1413 | MAT-POS-b3e365b9-1_1 |
|
EN300-264744_1_2 |
|
−1.6 ± 0.2 |
|
|
||||
| RUN1309 | MAT-POS-b3e365b9-1_1 |
|
EN300-52325_1_1 |
|
−1.6 ± 0.4 |
|
|
||||
| RUN833 | MAT-POS-b3e365b9-1_1 |
|
EN300-219020_1_1 |
|
−1.6 ± 0.2 |
|
|
||||
| RUN874 | MAT-POS-b3e365b9-1_1 |
|
EN300-6488034_1_1 |
|
−1.6 ± 0.4 |
|
|
||||
| RUN513 | MAT-POS-b3e365b9-1_1 |
|
EN300-113218_1_2 |
|
−1.6 ± 0.3 |
|
|
||||
| RUN908 | MAT-POS-b3e365b9-1_1 |
|
EN300-1968342_3_1 |
|
−1.6 ± 0.4 |
|
|
||||
| RUN1117 | MAT-POS-b3e365b9-1_1 |
|
EN300-20375_1_1 |
|
−1.6 ± 0.3 |
|
|
||||
| RUN1063 | MAT-POS-b3e365b9-1_1 |
|
EN300-1696962_4_1 |
|
−1.6 ± 0.4 |
|
|
||||
| RUN1689 | MAT-POS-b3e365b9-1_1 |
|
EN300-6473273_3_1 |
|
−1.6 ± 0.4 |
|
|
||||
| RUN844 | MAT-POS-b3e365b9-1_1 |
|
EN300-178293_3_1 |
|
−1.6 ± 0.6 |
|
|
||||
| RUN349 | MAT-POS-b3e365b9-1_1 |
|
EN300-05512_1_2 |
|
−1.6 ± 0.3 |
|
|
||||
| RUN62 | MAT-POS-b3e365b9-1_1 |
|
EDJ-MED-28ec730d-1_1 |
|
−1.6 ± 0.3 |
|
|
||||
| RUN238 | MAT-POS-b3e365b9-1_1 |
|
MAK-UNK-83e0a0b4-4_1 |
|
−1.6 ± 0.4 |
|
|
||||
| RUN1162 | MAT-POS-b3e365b9-1_1 |
|
EN300-31148_3_2 |
|
−1.6 ± 0.4 |
|
|
||||
| RUN645 | MAT-POS-b3e365b9-1_1 |
|
EN300-51735_2_2 |
|
−1.6 ± 0.3 |
|
|
||||
| RUN1303 | MAT-POS-b3e365b9-1_1 |
|
EN300-317082_4_1 |
|
−1.6 ± 0.2 |
|
|
||||
| RUN1543 | MAT-POS-b3e365b9-1_1 |
|
EN300-197715_4_1 |
|
−1.6 ± 0.3 |
|
|
||||
| RUN1556 | MAT-POS-b3e365b9-1_1 |
|
EN300-1968342_3_2 |
|
−1.6 ± 0.4 |
|
|
||||
| RUN331 | MAT-POS-b3e365b9-1_1 |
|
EN300-260816_2_2 |
|
−1.6 ± 0.3 |
|
|
||||
| RUN998 | MAT-POS-b3e365b9-1_1 |
|
EN300-246248_2_2 |
|
−1.6 ± 0.3 |
|
|
||||
| RUN1781 | MAT-POS-b3e365b9-1_1 |
|
EN300-1600786_2_1 |
|
−1.6 ± 0.4 |
|
|
||||
| RUN1739 | MAT-POS-b3e365b9-1_1 |
|
EN300-2977549_3_1 |
|
−1.6 ± 0.3 |
|
|
||||
| RUN704 | MAT-POS-b3e365b9-1_1 |
|
EN300-67023_1_2 |
|
−1.6 ± 0.4 |
|
|
||||
| RUN1220 | MAT-POS-b3e365b9-1_1 |
|
EN300-302290_3_1 |
|
−1.6 ± 0.4 |
|
|
||||
| RUN1583 | MAT-POS-b3e365b9-1_1 |
|
EN300-04409_1_1 |
|
−1.6 ± 0.3 |
|
|
||||
| RUN579 | MAT-POS-b3e365b9-1_1 |
|
EN300-1915260_4_2 |
|
−1.6 ± 0.4 |
|
|
||||
| RUN657 | MAT-POS-b3e365b9-1_1 |
|
EN300-360157_1_2 |
|
−1.6 ± 0.3 |
|
|
||||
| RUN973 | MAT-POS-b3e365b9-1_1 |
|
EN300-1215738_1_1 |
|
−1.6 ± 0.4 |
|
|
||||
| RUN759 | MAT-POS-b3e365b9-1_1 |
|
EN300-6238494_2_1 |
|
−1.6 ± 0.3 |
|
|
||||
| RUN123 | MAT-POS-b3e365b9-1_1 |
|
DAR-DIA-0d514e7d-18_1 |
|
−1.5 ± 0.1 |
|
|
||||
| RUN555 | MAT-POS-b3e365b9-1_1 |
|
EN300-219020_4_1 |
|
−1.5 ± 0.4 |
|
|
||||
| RUN1056 | MAT-POS-b3e365b9-1_1 |
|
EN300-2977549_1_1 |
|
−1.5 ± 0.2 |
|
|
||||
| RUN727 | MAT-POS-b3e365b9-1_1 |
|
EN300-222969_3_1 |
|
−1.5 ± 0.3 |
|
|
||||
| RUN518 | MAT-POS-b3e365b9-1_1 |
|
EN300-206592_3_2 |
|
−1.5 ± 0.5 |
|
|
||||
| RUN1229 | MAT-POS-b3e365b9-1_1 |
|
EN300-68740_1_1 |
|
−1.5 ± 0.4 |
|
|
||||
| RUN757 | MAT-POS-b3e365b9-1_1 |
|
EN300-10895_3_1 |
|
−1.5 ± 0.3 |
|
|
||||
| RUN397 | MAT-POS-b3e365b9-1_1 |
|
EN300-317555_1_1 |
|
−1.5 ± 0.2 |
|
|
||||
| RUN659 | MAT-POS-b3e365b9-1_1 |
|
EN300-125140_4_1 |
|
−1.5 ± 0.3 |
|
|
||||
| RUN556 | MAT-POS-b3e365b9-1_1 |
|
EN300-1253122_1_1 |
|
−1.5 ± 0.2 |
|
|
||||
| RUN515 | MAT-POS-b3e365b9-1_1 |
|
EN300-139167_4_1 |
|
−1.5 ± 0.3 |
|
|
||||
| RUN503 | MAT-POS-b3e365b9-1_1 |
|
EN300-217107_3_3 |
|
−1.5 ± 0.3 |
|
|
||||
| RUN1436 | MAT-POS-b3e365b9-1_1 |
|
EN300-1265949_3_2 |
|
−1.5 ± 0.5 |
|
|
||||
| RUN1482 | MAT-POS-b3e365b9-1_1 |
|
EN300-59285_3_1 |
|
−1.5 ± 0.3 |
|
|
||||
| RUN809 | MAT-POS-b3e365b9-1_1 |
|
EN300-17381_1_2 |
|
−1.5 ± 0.2 |
|
|
||||
| RUN425 | MAT-POS-b3e365b9-1_1 |
|
EN300-203293_3_1 |
|
−1.5 ± 0.3 |
|
|
||||
| RUN1676 | MAT-POS-b3e365b9-1_1 |
|
EN300-219531_1_2 |
|
−1.5 ± 0.3 |
|
|
||||
| RUN614 | MAT-POS-b3e365b9-1_1 |
|
EN300-76841_3_2 |
|
−1.5 ± 0.4 |
|
|
||||
| RUN198 | MAT-POS-b3e365b9-1_1 |
|
DAR-DIA-5ff57136-15_1 |
|
−1.5 ± 0.2 |
|
|
||||
| RUN1170 | MAT-POS-b3e365b9-1_1 |
|
EN300-152418_3_1 |
|
−1.5 ± 0.3 |
|
|
||||
| RUN222 | MAT-POS-b3e365b9-1_1 |
|
DAR-DIA-23e5a6a0-8_1 |
|
−1.5 ± 0.3 |
|
|
||||
| RUN1090 | MAT-POS-b3e365b9-1_1 |
|
EN300-128463_3_1 |
|
−1.5 ± 0.3 |
|
|
||||
| RUN1464 | MAT-POS-b3e365b9-1_1 |
|
EN300-263153_1_1 |
|
−1.5 ± 0.3 |
|
|
||||
| RUN882 | MAT-POS-b3e365b9-1_1 |
|
EN300-146174_3_1 |
|
−1.5 ± 0.3 |
|
|
||||
| RUN1729 | MAT-POS-b3e365b9-1_1 |
|
EN300-207959_3_2 |
|
−1.5 ± 0.6 |
|
|
||||
| RUN676 | MAT-POS-b3e365b9-1_1 |
|
EN300-105267_1_1 |
|
−1.5 ± 0.2 |
|
|
||||
| RUN1609 | MAT-POS-b3e365b9-1_1 |
|
EN300-137191_3_1 |
|
−1.5 ± 0.4 |
|
|
||||
| RUN688 | MAT-POS-b3e365b9-1_1 |
|
EN300-204935_3_1 |
|
−1.5 ± 0.3 |
|
|
||||
| RUN840 | MAT-POS-b3e365b9-1_1 |
|
EN300-219020_1_1 |
|
−1.5 ± 0.2 |
|
|
||||
| RUN483 | MAT-POS-b3e365b9-1_1 |
|
EN300-1968342_2_1 |
|
−1.5 ± 0.3 |
|
|
||||
| RUN634 | MAT-POS-b3e365b9-1_1 |
|
EN300-10414_2_1 |
|
−1.5 ± 0.3 |
|
|
||||
| RUN1520 | MAT-POS-b3e365b9-1_1 |
|
EN300-1629199_1_1 |
|
−1.5 ± 0.3 |
|
|
||||
| RUN309 | MAT-POS-b3e365b9-1_1 |
|
EN300-6238494_1_2 |
|
−1.5 ± 0.3 |
|
|
||||
| RUN917 | MAT-POS-b3e365b9-1_1 |
|
EN300-4726186_1_1 |
|
−1.5 ± 0.5 |
|
|
||||
| RUN474 | MAT-POS-b3e365b9-1_1 |
|
EN300-246992_1_2 |
|
−1.5 ± 0.2 |
|
|
||||
| RUN1330 | MAT-POS-b3e365b9-1_1 |
|
EN300-68747_3_1 |
|
−1.5 ± 0.3 |
|
|
||||
| RUN532 | MAT-POS-b3e365b9-1_1 |
|
EN300-1241327_1_1 |
|
−1.5 ± 0.3 |
|
|
||||
| RUN401 | MAT-POS-b3e365b9-1_1 |
|
EN300-1273362_3_1 |
|
−1.5 ± 0.4 |
|
|
||||
| RUN1765 | MAT-POS-b3e365b9-1_1 |
|
EN300-47606_2_2 |
|
−1.5 ± 0.5 |
|
|
||||
| RUN680 | MAT-POS-b3e365b9-1_1 |
|
EN300-139167_3_2 |
|
−1.5 ± 0.3 |
|
|
||||
| RUN611 | MAT-POS-b3e365b9-1_1 |
|
EN300-2977549_4_1 |
|
−1.5 ± 0.3 |
|
|
||||
| RUN1466 | MAT-POS-b3e365b9-1_1 |
|
EN300-88131_1_1 |
|
−1.5 ± 0.2 |
|
|
||||
| RUN1750 | MAT-POS-b3e365b9-1_1 |
|
EN300-364679_4_1 |
|
−1.5 ± 0.4 |
|
|
||||
| RUN31 | MAT-POS-b3e365b9-1_1 |
|
EDJ-MED-28ec730d-5_1 |
|
−1.5 ± 0.2 |
|
|
||||
| RUN1317 | MAT-POS-b3e365b9-1_1 |
|
EN300-10747_1_1 |
|
−1.5 ± 0.2 |
|
|
||||
| RUN880 | MAT-POS-b3e365b9-1_1 |
|
EN300-22880_1_2 |
|
−1.5 ± 0.3 |
|
|
||||
| RUN724 | MAT-POS-b3e365b9-1_1 |
|
EN300-75342_2_1 |
|
−1.5 ± 0.3 |
|
|
||||
| RUN584 | MAT-POS-b3e365b9-1_1 |
|
EN300-1253122_3_1 |
|
−1.5 ± 0.3 |
|
|
||||
| RUN990 | MAT-POS-b3e365b9-1_1 |
|
EN300-222357_2_1 |
|
−1.4 ± 0.3 |
|
|
||||
| RUN497 | MAT-POS-b3e365b9-1_1 |
|
EN300-6735421_3_1 |
|
−1.4 ± 0.5 |
|
|
||||
| RUN107 | MAT-POS-b3e365b9-1_1 |
|
VLA-UCB-50c39ae8-8_2 |
|
−1.4 ± 0.2 |
|
|
||||
| RUN105 | MAT-POS-b3e365b9-1_1 |
|
DAR-DIA-0d514e7d-6_1 |
|
−1.4 ± 0.2 |
|
|
||||
| RUN385 | MAT-POS-b3e365b9-1_1 |
|
EN300-393148_3_1 |
|
−1.4 ± 0.3 |
|
|
||||
| RUN641 | MAT-POS-b3e365b9-1_1 |
|
EN300-178515_1_1 |
|
−1.4 ± 0.2 |
|
|
||||
| RUN560 | MAT-POS-b3e365b9-1_1 |
|
EN300-17184_3_1 |
|
−1.4 ± 0.3 |
|
|
||||