| RUN | Initial microstate | Final microstate | ΔΔG / kcal M-1 | Work distribution | Convergence | ||||||
|---|---|---|---|---|---|---|---|---|---|---|---|
| RUN1095 | MAT-POS-b3e365b9-1_1 |
|
EN300-102347_4_1 |
|
−0.1 ± 0.4 |
|
|
||||
| RUN1080 | MAT-POS-b3e365b9-1_1 |
|
EN300-73582_1_1 |
|
−0.1 ± 0.4 |
|
|
||||
| RUN360 | MAT-POS-b3e365b9-1_1 |
|
EN300-125409_2_1 |
|
−0.1 ± 0.3 |
|
|
||||
| RUN419 | MAT-POS-b3e365b9-1_1 |
|
EN300-25572_2_1 |
|
−0.1 ± 0.3 |
|
|
||||
| RUN1259 | MAT-POS-b3e365b9-1_1 |
|
EN300-7444106_2_2 |
|
−0.1 ± 0.2 |
|
|
||||
| RUN693 | MAT-POS-b3e365b9-1_1 |
|
EN300-102007_1_2 |
|
−0.1 ± 0.4 |
|
|
||||
| RUN1129 | MAT-POS-b3e365b9-1_1 |
|
EN300-1387145_2_4 |
|
−0.1 ± 0.2 |
|
|
||||
| RUN1302 | MAT-POS-b3e365b9-1_1 |
|
EN300-28177_2_2 |
|
−0.1 ± 0.4 |
|
|
||||
| RUN1480 | MAT-POS-b3e365b9-1_1 |
|
EN300-1915260_1_2 |
|
−0.1 ± 0.3 |
|
|
||||
| RUN991 | MAT-POS-b3e365b9-1_1 |
|
EN300-270710_4_1 |
|
−0.1 ± 0.4 |
|
|
||||
| RUN856 | MAT-POS-b3e365b9-1_1 |
|
EN300-114134_1_1 |
|
−0.1 ± 0.3 |
|
|
||||
| RUN796 | MAT-POS-b3e365b9-1_1 |
|
EN300-20284_2_1 |
|
−0.1 ± 0.3 |
|
|
||||
| RUN804 | MAT-POS-b3e365b9-1_1 |
|
EN300-68882_2_1 |
|
−0.1 ± 0.3 |
|
|
||||
| RUN1251 | MAT-POS-b3e365b9-1_1 |
|
EN300-173903_2_1 |
|
−0.1 ± 0.3 |
|
|
||||
| RUN61 | MAT-POS-b3e365b9-1_1 |
|
BEN-DND-c852c98b-2_1 |
|
−0.08 ± 0.07 |
|
|
||||
| RUN1192 | MAT-POS-b3e365b9-1_1 |
|
EN300-02067_1_2 |
|
−0.1 ± 0.2 |
|
|
||||
| RUN1782 | MAT-POS-b3e365b9-1_1 |
|
EN300-183231_4_1 |
|
−0.1 ± 0.6 |
|
|
||||
| RUN256 | MAT-POS-b3e365b9-1_1 |
|
DAR-DIA-5ff57136-9_1 |
|
−0.1 ± 0.3 |
|
|
||||
| RUN581 | MAT-POS-b3e365b9-1_1 |
|
EN300-268198_2_2 |
|
−0.1 ± 0.4 |
|
|
||||
| RUN443 | MAT-POS-b3e365b9-1_1 |
|
EN300-37195_2_1 |
|
−0.1 ± 0.3 |
|
|
||||
| RUN539 | MAT-POS-b3e365b9-1_1 |
|
EN300-79588_4_1 |
|
−0.1 ± 0.4 |
|
|
||||
| RUN215 | MAT-POS-b3e365b9-1_1 |
|
DAR-DIA-0d514e7d-26_1 |
|
−0.1 ± 0.2 |
|
|
||||
| RUN968 | MAT-POS-b3e365b9-1_1 |
|
EN300-102988_1_1 |
|
−0.1 ± 0.3 |
|
|
||||
| RUN375 | MAT-POS-b3e365b9-1_1 |
|
EN300-1425608_1_1 |
|
−0.1 ± 0.4 |
|
|
||||
| RUN36 | MAT-POS-b3e365b9-1_1 |
|
EDJ-MED-e4b030d8-2_1 |
|
−0.05 ± 0.05 |
|
|
||||
| RUN1188 | MAT-POS-b3e365b9-1_1 |
|
EN300-1265949_3_1 |
|
−0.1 ± 0.4 |
|
|
||||
| RUN1039 | MAT-POS-b3e365b9-1_1 |
|
EN300-7003350_4_1 |
|
−0.0 ± 0.3 |
|
|
||||
| RUN172 | MAT-POS-b3e365b9-1_1 |
|
DAR-DIA-0d514e7d-27_1 |
|
−0.0 ± 0.2 |
|
|
||||
| RUN1027 | MAT-POS-b3e365b9-1_1 |
|
EN300-96001_2_1 |
|
−0.0 ± 0.4 |
|
|
||||
| RUN1456 | MAT-POS-b3e365b9-1_1 |
|
EN300-23129_1_1 |
|
−0.0 ± 0.3 |
|
|
||||
| RUN710 | MAT-POS-b3e365b9-1_1 |
|
EN300-6970573_2_1 |
|
−0.0 ± 0.3 |
|
|
||||
| RUN434 | MAT-POS-b3e365b9-1_1 |
|
EN300-97904_1_1 |
|
−0.0 ± 0.3 |
|
|
||||
| RUN64 | MAT-POS-b3e365b9-1_1 |
|
ADA-UCB-dc2b944c-12_1 |
|
−0.03 ± 0.08 |
|
|
||||
| RUN761 | MAT-POS-b3e365b9-1_1 |
|
EN300-342462_1_1 |
|
−0.0 ± 0.4 |
|
|
||||
| RUN740 | MAT-POS-b3e365b9-1_1 |
|
EN300-1703718_3_1 |
|
−0.0 ± 0.3 |
|
|
||||
| RUN635 | MAT-POS-b3e365b9-1_1 |
|
EN300-216063_4_1 |
|
−0.0 ± 0.3 |
|
|
||||
| RUN865 | MAT-POS-b3e365b9-1_1 |
|
EN300-66082_2_2 |
|
−0.0 ± 0.4 |
|
|
||||
| RUN1449 | MAT-POS-b3e365b9-1_1 |
|
EN300-10170_2_1 |
|
−0.0 ± 0.3 |
|
|
||||
| RUN337 | MAT-POS-b3e365b9-1_1 |
|
EN300-1911992_3_2 |
|
−0.0 ± 0.3 |
|
|
||||
| RUN799 | MAT-POS-b3e365b9-1_1 |
|
EN300-48760_2_1 |
|
−0.0 ± 0.4 |
|
|
||||
| RUN915 | MAT-POS-b3e365b9-1_1 |
|
EN300-16216_2_1 |
|
−0.0 ± 0.2 |
|
|
||||
| RUN582 | MAT-POS-b3e365b9-1_1 |
|
EN300-110012_3_1 |
|
−0.0 ± 0.4 |
|
|
||||
| RUN885 | MAT-POS-b3e365b9-1_1 |
|
EN300-86732_1_2 |
|
−0.0 ± 0.4 |
|
|
||||
| RUN225 | MAT-POS-b3e365b9-1_1 |
|
DAR-DIA-23e5a6a0-1_1 |
|
−0.0 ± 0.3 |
|
|
||||
| RUN822 | MAT-POS-b3e365b9-1_1 |
|
EN300-6491697_1_1 |
|
−0.0 ± 0.3 |
|
|
||||
| RUN1549 | MAT-POS-b3e365b9-1_1 |
|
EN300-210084_1_2 |
|
0.0 ± 0.3 |
|
|
||||
| RUN416 | MAT-POS-b3e365b9-1_1 |
|
EN300-378343_2_2 |
|
0.0 ± 0.3 |
|
|
||||
| RUN928 | MAT-POS-b3e365b9-1_1 |
|
EN300-1724771_1_1 |
|
0.0 ± 0.5 |
|
|
||||
| RUN15 | MAT-POS-b3e365b9-1_1 |
|
VLA-UCB-1dbca3b4-15_1 |
|
0.01 ± 0.02 |
|
|
||||
| RUN1657 | MAT-POS-b3e365b9-1_1 |
|
EN300-6493742_1_1 |
|
0.0 ± 0.5 |
|
|
||||
| RUN1271 | MAT-POS-b3e365b9-1_1 |
|
EN300-20496_4_1 |
|
0.0 ± 0.4 |
|
|
||||
| RUN784 | MAT-POS-b3e365b9-1_1 |
|
EN300-1706036_4_1 |
|
0.0 ± 0.3 |
|
|
||||
| RUN17 | MAT-POS-b3e365b9-1_1 |
|
MAT-POS-f7918075-1_1 |
|
0.01 ± 0.03 |
|
|
||||
| RUN511 | MAT-POS-b3e365b9-1_1 |
|
EN300-117414_2_1 |
|
0.0 ± 0.3 |
|
|
||||
| RUN1366 | MAT-POS-b3e365b9-1_1 |
|
EN300-35592_2_1 |
|
0.0 ± 0.5 |
|
|
||||
| RUN1487 | MAT-POS-b3e365b9-1_1 |
|
EN300-1699871_4_1 |
|
0.0 ± 0.3 |
|
|
||||
| RUN722 | MAT-POS-b3e365b9-1_1 |
|
EN300-204935_4_1 |
|
0.0 ± 0.3 |
|
|
||||
| RUN950 | MAT-POS-b3e365b9-1_1 |
|
EN300-7003350_2_1 |
|
0.0 ± 0.2 |
|
|
||||
| RUN760 | MAT-POS-b3e365b9-1_1 |
|
EN300-221518_4_1 |
|
0.0 ± 0.3 |
|
|
||||
| RUN1055 | MAT-POS-b3e365b9-1_1 |
|
EN300-260816_4_1 |
|
0.0 ± 0.4 |
|
|
||||
| RUN573 | MAT-POS-b3e365b9-1_1 |
|
EN300-179091_2_1 |
|
0.0 ± 0.2 |
|
|
||||
| RUN97 | MAT-POS-b3e365b9-1_1 |
|
BEN-BAS-5c03e89e-1_1 |
|
0.0 ± 0.2 |
|
|
||||
| RUN100 | MAT-POS-b3e365b9-1_1 |
|
ALP-POS-477dc5b7-3_2 |
|
0.0 ± 0.2 |
|
|
||||
| RUN335 | MAT-POS-b3e365b9-1_1 |
|
EN300-7500524_1_1 |
|
0.0 ± 0.3 |
|
|
||||
| RUN830 | MAT-POS-b3e365b9-1_1 |
|
EN300-30572_1_1 |
|
0.0 ± 0.4 |
|
|
||||
| RUN1382 | MAT-POS-b3e365b9-1_1 |
|
EN300-77092_2_1 |
|
0.0 ± 0.2 |
|
|
||||
| RUN1743 | MAT-POS-b3e365b9-1_1 |
|
EN300-6501360_1_2 |
|
0.0 ± 0.5 |
|
|
||||
| RUN52 | MAT-POS-b3e365b9-1_1 |
|
JOH-SUS-a69c159d-5_1 |
|
0.05 ± 0.06 |
|
|
||||
| RUN828 | MAT-POS-b3e365b9-1_1 |
|
EN300-109920_2_1 |
|
0.1 ± 0.6 |
|
|
||||
| RUN625 | MAT-POS-b3e365b9-1_1 |
|
EN300-132523_1_1 |
|
0.1 ± 0.4 |
|
|
||||
| RUN471 | MAT-POS-b3e365b9-1_1 |
|
EN300-7433071_1_2 |
|
0.1 ± 0.6 |
|
|
||||
| RUN39 | MAT-POS-b3e365b9-1_1 |
|
MAT-POS-11b63608-1_1 |
|
0.06 ± 0.05 |
|
|
||||
| RUN1151 | MAT-POS-b3e365b9-1_1 |
|
EN300-139167_4_2 |
|
0.1 ± 0.4 |
|
|
||||
| RUN891 | MAT-POS-b3e365b9-1_1 |
|
EN300-101373_2_1 |
|
0.1 ± 0.3 |
|
|
||||
| RUN410 | MAT-POS-b3e365b9-1_1 |
|
EN300-36850_1_1 |
|
0.1 ± 0.3 |
|
|
||||
| RUN1628 | MAT-POS-b3e365b9-1_1 |
|
EN300-306495_1_1 |
|
0.1 ± 0.3 |
|
|
||||
| RUN35 | MAT-POS-b3e365b9-1_1 |
|
BEN-DND-c852c98b-7_1 |
|
0.07 ± 0.06 |
|
|
||||
| RUN924 | MAT-POS-b3e365b9-1_1 |
|
EN300-23317_3_1 |
|
0.1 ± 0.5 |
|
|
||||
| RUN278 | MAT-POS-b3e365b9-1_1 |
|
EN300-05277_2_1 |
|
0.1 ± 0.4 |
|
|
||||
| RUN82 | MAT-POS-b3e365b9-1_1 |
|
DAR-DIA-6a508060-4_2 |
|
0.1 ± 0.1 |
|
|
||||
| RUN151 | MAT-POS-b3e365b9-1_1 |
|
DAR-DIA-0d514e7d-19_1 |
|
0.1 ± 0.2 |
|
|
||||
| RUN815 | MAT-POS-b3e365b9-1_1 |
|
EN300-370967_2_1 |
|
0.1 ± 0.3 |
|
|
||||
| RUN424 | MAT-POS-b3e365b9-1_1 |
|
EN300-314088_2_1 |
|
0.1 ± 0.3 |
|
|
||||
| RUN836 | MAT-POS-b3e365b9-1_1 |
|
EN300-378343_2_1 |
|
0.1 ± 0.3 |
|
|
||||
| RUN153 | MAT-POS-b3e365b9-1_1 |
|
DAR-DIA-23e5a6a0-10_2 |
|
0.1 ± 0.3 |
|
|
||||
| RUN642 | MAT-POS-b3e365b9-1_1 |
|
EN300-23214_2_1 |
|
0.1 ± 0.4 |
|
|
||||
| RUN169 | MAT-POS-b3e365b9-1_1 |
|
EDJ-MED-28ec730d-3_1 |
|
0.1 ± 0.2 |
|
|
||||
| RUN321 | MAT-POS-b3e365b9-1_1 |
|
EN300-114134_3_1 |
|
0.1 ± 0.4 |
|
|
||||
| RUN484 | MAT-POS-b3e365b9-1_1 |
|
EN300-1699871_4_2 |
|
0.1 ± 0.3 |
|
|
||||
| RUN275 | MAT-POS-b3e365b9-1_1 |
|
EN300-1238839_2_1 |
|
0.1 ± 0.3 |
|
|
||||
| RUN1710 | MAT-POS-b3e365b9-1_1 |
|
EN300-04492_4_1 |
|
0.1 ± 0.5 |
|
|
||||
| RUN440 | MAT-POS-b3e365b9-1_1 |
|
EN300-818706_2_1 |
|
0.1 ± 0.3 |
|
|
||||
| RUN899 | MAT-POS-b3e365b9-1_1 |
|
EN300-67533_2_1 |
|
0.1 ± 0.3 |
|
|
||||
| RUN1158 | MAT-POS-b3e365b9-1_1 |
|
EN300-13668_2_1 |
|
0.1 ± 0.3 |
|
|
||||
| RUN923 | MAT-POS-b3e365b9-1_1 |
|
EN300-25791_2_1 |
|
0.1 ± 0.3 |
|
|
||||
| RUN1119 | MAT-POS-b3e365b9-1_1 |
|
EN300-331993_4_1 |
|
0.1 ± 0.3 |
|
|
||||
| RUN768 | MAT-POS-b3e365b9-1_1 |
|
EN300-221518_4_1 |
|
0.1 ± 0.3 |
|
|
||||
| RUN837 | MAT-POS-b3e365b9-1_1 |
|
EN300-36851_1_4 |
|
0.1 ± 0.3 |
|
|
||||
| RUN1195 | MAT-POS-b3e365b9-1_1 |
|
EN300-1709410_2_4 |
|
0.1 ± 0.3 |
|
|
||||
| RUN1130 | MAT-POS-b3e365b9-1_1 |
|
EN300-260603_1_1 |
|
0.1 ± 0.3 |
|
|
||||