| RUN | Initial microstate | Final microstate | ΔΔG / kcal M-1 | Work distribution | Convergence | ||||||
|---|---|---|---|---|---|---|---|---|---|---|---|
| RUN7509 | MAT-POS-b3e365b9-1_1 |
|
EN300-1692359_2_2_1 |
|
−1.2 ± 0.3 |
|
|
||||
| RUN4337 | MAT-POS-b3e365b9-1_1 |
|
EN300-53677_1_1_1 |
|
−1.2 ± 0.2 |
|
|
||||
| RUN3823 | MAT-POS-b3e365b9-1_1 |
|
EN300-101443_1_1_1 |
|
−1.2 ± 0.2 |
|
|
||||
| RUN3331 | MAT-POS-b3e365b9-1_1 |
|
EN300-114805_3_1_1 |
|
−1.2 ± 0.2 |
|
|
||||
| RUN5178 | MAT-POS-b3e365b9-1_1 |
|
EN300-202922_3_1_1 |
|
−1.2 ± 0.4 |
|
|
||||
| RUN6408 | MAT-POS-b3e365b9-1_1 |
|
EN300-6746890_1_1_1 |
|
−1.2 ± 0.2 |
|
|
||||
| RUN7017 | MAT-POS-b3e365b9-1_1 |
|
EN300-72211_3_1_1 |
|
−1.2 ± 0.3 |
|
|
||||
| RUN3007 | MAT-POS-b3e365b9-1_1 |
|
EN300-65839_3_1_1 |
|
−1.2 ± 0.3 |
|
|
||||
| RUN3706 | MAT-POS-b3e365b9-1_1 |
|
EN300-1258964_3_2_1 |
|
−1.2 ± 0.3 |
|
|
||||
| RUN4695 | MAT-POS-b3e365b9-1_1 |
|
EN300-262409_1_1_1 |
|
−1.2 ± 0.2 |
|
|
||||
| RUN4841 | MAT-POS-b3e365b9-1_1 |
|
EN300-1241327_1_1_1 |
|
−1.2 ± 0.2 |
|
|
||||
| RUN4268 | MAT-POS-b3e365b9-1_1 |
|
EN300-17184_3_1_1 |
|
−1.2 ± 0.3 |
|
|
||||
| RUN1485 | MAT-POS-b3e365b9-1_1 |
|
ED_-GRI-5b13fbe2-71_1 |
|
−1.2 ± 0.3 |
|
|
||||
| RUN3550 | MAT-POS-b3e365b9-1_1 |
|
EN300-6473108_1_1_1 |
|
−1.2 ± 0.2 |
|
|
||||
| RUN2626 | MAT-POS-b3e365b9-1_1 |
|
ALP-UNI-dbbfd3db-13_2 |
|
−1.2 ± 0.3 |
|
|
||||
| RUN3052 | MAT-POS-b3e365b9-1_1 |
|
EN300-94945_1_1_1 |
|
−1.2 ± 0.2 |
|
|
||||
| RUN6004 | MAT-POS-b3e365b9-1_1 |
|
EN300-39961_1_1_1 |
|
−1.2 ± 0.4 |
|
|
||||
| RUN6226 | MAT-POS-b3e365b9-1_1 |
|
EN300-158274_3_1_1 |
|
−1.2 ± 0.4 |
|
|
||||
| RUN5189 | MAT-POS-b3e365b9-1_1 |
|
EN300-227055_1_2_1 |
|
−1.2 ± 0.2 |
|
|
||||
| RUN4947 | MAT-POS-b3e365b9-1_1 |
|
EN300-18561_3_1_1 |
|
−1.2 ± 0.3 |
|
|
||||
| RUN4448 | MAT-POS-b3e365b9-1_1 |
|
EN300-25702_1_1_1 |
|
−1.2 ± 0.2 |
|
|
||||
| RUN5281 | MAT-POS-b3e365b9-1_1 |
|
EN300-131093_4_1_1 |
|
−1.2 ± 0.4 |
|
|
||||
| RUN6954 | MAT-POS-b3e365b9-1_1 |
|
EN300-385132_1_1_1 |
|
−1.2 ± 0.9 |
|
|
||||
| RUN488 | MAT-POS-b3e365b9-1_1 |
|
MIC-UNK-cdc2493e-24_1 |
|
−1.2 ± 0.3 |
|
|
||||
| RUN1791 | MAT-POS-b3e365b9-1_1 |
|
EDG-MED-90036822-108_1 |
|
−1.2 ± 0.3 |
|
|
||||
| RUN5988 | MAT-POS-b3e365b9-1_1 |
|
EN300-250836_1_1_1 |
|
−1.2 ± 0.2 |
|
|
||||
| RUN346 | MAT-POS-b3e365b9-1_1 |
|
DAR-DIA-23e5a6a0-10_1 |
|
−1.2 ± 0.3 |
|
|
||||
| RUN4621 | MAT-POS-b3e365b9-1_1 |
|
EN300-6494158_1_1_1 |
|
−1.2 ± 0.3 |
|
|
||||
| RUN2048 | MAT-POS-b3e365b9-1_1 |
|
KAD-UNI-8a629cb0-38_2 |
|
−1.2 ± 0.3 |
|
|
||||
| RUN630 | MAT-POS-b3e365b9-1_1 |
|
VLA-UCB-34f3ed0c-5_1 |
|
−1.2 ± 0.4 |
|
|
||||
| RUN3898 | MAT-POS-b3e365b9-1_1 |
|
EN300-5309123_1_1_1 |
|
−1.2 ± 0.3 |
|
|
||||
| RUN5152 | MAT-POS-b3e365b9-1_1 |
|
EN300-73772_2_1_2 |
|
−1.2 ± 0.3 |
|
|
||||
| RUN2450 | MAT-POS-b3e365b9-1_1 |
|
EDJ-MED-d203f206-40_1 |
|
−1.2 ± 0.3 |
|
|
||||
| RUN5398 | MAT-POS-b3e365b9-1_1 |
|
EN300-46832_3_2_1 |
|
−1.2 ± 0.3 |
|
|
||||
| RUN6729 | MAT-POS-b3e365b9-1_1 |
|
EN300-316216_1_1_1 |
|
−1.2 ± 0.2 |
|
|
||||
| RUN5565 | MAT-POS-b3e365b9-1_1 |
|
EN300-14458_3_1_1 |
|
−1.2 ± 0.2 |
|
|
||||
| RUN4741 | MAT-POS-b3e365b9-1_1 |
|
EN300-1693852_1_1_1 |
|
−1.2 ± 0.3 |
|
|
||||
| RUN5672 | MAT-POS-b3e365b9-1_1 |
|
EN300-302290_4_1_1 |
|
−1.2 ± 0.4 |
|
|
||||
| RUN599 | MAT-POS-b3e365b9-1_1 |
|
VLA-UCB-34f3ed0c-6_1 |
|
−1.2 ± 0.5 |
|
|
||||
| RUN4712 | MAT-POS-b3e365b9-1_1 |
|
EN300-2977549_1_1_1 |
|
−1.2 ± 0.2 |
|
|
||||
| RUN587 | MAT-POS-b3e365b9-1_1 |
|
EDJ-MED-28ec730d-2_1 |
|
−1.2 ± 0.1 |
|
|
||||
| RUN4933 | MAT-POS-b3e365b9-1_1 |
|
EN300-53423_1_1_1 |
|
−1.2 ± 0.3 |
|
|
||||
| RUN4987 | MAT-POS-b3e365b9-1_1 |
|
EN300-1238839_1_1_1 |
|
−1.2 ± 0.3 |
|
|
||||
| RUN5218 | MAT-POS-b3e365b9-1_1 |
|
EN300-193679_2_1_1 |
|
−1.2 ± 0.3 |
|
|
||||
| RUN543 | MAT-POS-b3e365b9-1_1 |
|
VLA-UCB-34f3ed0c-15_1 |
|
−1.2 ± 0.5 |
|
|
||||
| RUN6168 | MAT-POS-b3e365b9-1_1 |
|
EN300-173020_2_1_1 |
|
−1.2 ± 0.3 |
|
|
||||
| RUN3206 | MAT-POS-b3e365b9-1_1 |
|
EN300-217107_1_3_1 |
|
−1.2 ± 0.2 |
|
|
||||
| RUN7091 | MAT-POS-b3e365b9-1_1 |
|
EN300-263085_4_1_1 |
|
−1.2 ± 0.3 |
|
|
||||
| RUN4854 | MAT-POS-b3e365b9-1_1 |
|
EN300-1662365_1_1_1 |
|
−1.2 ± 0.3 |
|
|
||||
| RUN4087 | MAT-POS-b3e365b9-1_1 |
|
EN300-1722017_1_1_1 |
|
−1.2 ± 0.3 |
|
|
||||
| RUN727 | MAT-POS-b3e365b9-1_1 |
|
DAR-DIA-0d514e7d-30_1 |
|
−1.2 ± 0.2 |
|
|
||||
| RUN4591 | MAT-POS-b3e365b9-1_1 |
|
EN300-2977549_2_1_1 |
|
−1.2 ± 0.2 |
|
|
||||
| RUN5551 | MAT-POS-b3e365b9-1_1 |
|
EN300-19542_2_1_1 |
|
−1.2 ± 0.3 |
|
|
||||
| RUN4069 | MAT-POS-b3e365b9-1_1 |
|
EN300-7439284_1_1_1 |
|
−1.2 ± 0.3 |
|
|
||||
| RUN5607 | MAT-POS-b3e365b9-1_1 |
|
EN300-316679_1_1_1 |
|
−1.2 ± 0.3 |
|
|
||||
| RUN6552 | MAT-POS-b3e365b9-1_1 |
|
EN300-154332_1_2_1 |
|
−1.2 ± 0.3 |
|
|
||||
| RUN6618 | MAT-POS-b3e365b9-1_1 |
|
EN300-6482967_1_1_1 |
|
−1.2 ± 0.3 |
|
|
||||
| RUN5384 | MAT-POS-b3e365b9-1_1 |
|
EN300-224741_3_1_1 |
|
−1.2 ± 0.3 |
|
|
||||
| RUN7598 | MAT-POS-b3e365b9-1_1 |
|
EN300-226314_3_1_1 |
|
−1.2 ± 0.4 |
|
|
||||
| RUN6474 | MAT-POS-b3e365b9-1_1 |
|
EN300-04492_4_1_1 |
|
−1.2 ± 0.3 |
|
|
||||
| RUN4116 | MAT-POS-b3e365b9-1_1 |
|
EN300-59487_3_2_1 |
|
−1.2 ± 0.2 |
|
|
||||
| RUN4317 | MAT-POS-b3e365b9-1_1 |
|
EN300-173903_1_1_1 |
|
−1.2 ± 0.4 |
|
|
||||
| RUN773 | MAT-POS-b3e365b9-1_1 |
|
DAR-DIA-0d514e7d-32_19 |
|
−1.2 ± 0.3 |
|
|
||||
| RUN6867 | MAT-POS-b3e365b9-1_1 |
|
EN300-219437_1_1_1 |
|
−1.2 ± 0.3 |
|
|
||||
| RUN7620 | MAT-POS-b3e365b9-1_1 |
|
EN300-6491682_2_1_1 |
|
−1.2 ± 0.3 |
|
|
||||
| RUN3999 | MAT-POS-b3e365b9-1_1 |
|
EN300-1726340_2_1_1 |
|
−1.2 ± 0.4 |
|
|
||||
| RUN3925 | MAT-POS-b3e365b9-1_1 |
|
EN300-46832_3_1_1 |
|
−1.2 ± 0.3 |
|
|
||||
| RUN6257 | MAT-POS-b3e365b9-1_1 |
|
EN300-14395_1_1_1 |
|
−1.2 ± 0.2 |
|
|
||||
| RUN3202 | MAT-POS-b3e365b9-1_1 |
|
EN300-249899_1_1_1 |
|
−1.2 ± 0.2 |
|
|
||||
| RUN411 | MAT-POS-b3e365b9-1_1 |
|
RAL-THA-065e0743-2_2 |
|
−1.2 ± 0.4 |
|
|
||||
| RUN5615 | MAT-POS-b3e365b9-1_1 |
|
EN300-86205_3_1_2 |
|
−1.2 ± 0.3 |
|
|
||||
| RUN36 | MAT-POS-b3e365b9-1_1 |
|
PET-UNK-c9c1e0d8-4_2 |
|
−1.2 ± 0.3 |
|
|
||||
| RUN2272 | MAT-POS-b3e365b9-1_1 |
|
ALP-POS-2da19ca7-7_1 |
|
−1.2 ± 0.3 |
|
|
||||
| RUN3766 | MAT-POS-b3e365b9-1_1 |
|
EN300-246248_1_2_1 |
|
−1.2 ± 0.2 |
|
|
||||
| RUN1605 | MAT-POS-b3e365b9-1_1 |
|
EDG-MED-90036822-66_1 |
|
−1.2 ± 0.2 |
|
|
||||
| RUN5997 | MAT-POS-b3e365b9-1_1 |
|
EN300-101505_2_1_1 |
|
−1.2 ± 0.2 |
|
|
||||
| RUN4273 | MAT-POS-b3e365b9-1_1 |
|
EN300-20496_4_1_1 |
|
−1.2 ± 0.3 |
|
|
||||
| RUN6246 | MAT-POS-b3e365b9-1_1 |
|
EN300-70522_1_1_1 |
|
−1.2 ± 0.4 |
|
|
||||
| RUN3856 | MAT-POS-b3e365b9-1_1 |
|
EN300-10414_1_1_1 |
|
−1.2 ± 0.4 |
|
|
||||
| RUN3451 | MAT-POS-b3e365b9-1_1 |
|
EN300-51350_1_2_1 |
|
−1.2 ± 0.2 |
|
|
||||
| RUN4868 | MAT-POS-b3e365b9-1_1 |
|
EN300-4287199_1_1_1 |
|
−1.2 ± 0.3 |
|
|
||||
| RUN6532 | MAT-POS-b3e365b9-1_1 |
|
EN300-67302_1_1_1 |
|
−1.2 ± 0.3 |
|
|
||||
| RUN7766 | MAT-POS-b3e365b9-1_1 |
|
EN300-151423_4_1_1 |
|
−1.2 ± 0.3 |
|
|
||||
| RUN3698 | MAT-POS-b3e365b9-1_1 |
|
EN300-1932780_1_1_1 |
|
−1.2 ± 0.2 |
|
|
||||
| RUN5503 | MAT-POS-b3e365b9-1_1 |
|
EN300-316216_3_1_1 |
|
−1.2 ± 0.3 |
|
|
||||
| RUN3980 | MAT-POS-b3e365b9-1_1 |
|
EN300-16582_1_2_1 |
|
−1.2 ± 0.3 |
|
|
||||
| RUN3002 | MAT-POS-b3e365b9-1_1 |
|
EN300-174668_1_2_1 |
|
−1.2 ± 0.4 |
|
|
||||
| RUN1033 | MAT-POS-b3e365b9-1_1 |
|
MAK-UNK-c749d764-28_6 |
|
−1.2 ± 0.3 |
|
|
||||
| RUN5043 | MAT-POS-b3e365b9-1_1 |
|
EN300-6491795_1_1_1 |
|
−1.2 ± 0.3 |
|
|
||||
| RUN7465 | MAT-POS-b3e365b9-1_1 |
|
EN300-246178_1_1_1 |
|
−1.2 ± 0.3 |
|
|
||||
| RUN3086 | MAT-POS-b3e365b9-1_1 |
|
EN300-30397_1_1_1 |
|
−1.2 ± 0.3 |
|
|
||||
| RUN4246 | MAT-POS-b3e365b9-1_1 |
|
EN300-364679_4_1_1 |
|
−1.2 ± 0.3 |
|
|
||||
| RUN5317 | MAT-POS-b3e365b9-1_1 |
|
EN300-201180_1_4_1 |
|
−1.2 ± 0.3 |
|
|
||||
| RUN6971 | MAT-POS-b3e365b9-1_1 |
|
EN300-18064_1_1_1 |
|
−1.2 ± 0.2 |
|
|
||||
| RUN3357 | MAT-POS-b3e365b9-1_1 |
|
EN300-88656_1_2_1 |
|
−1.2 ± 0.3 |
|
|
||||
| RUN3781 | MAT-POS-b3e365b9-1_1 |
|
EN300-254121_1_1_1 |
|
−1.2 ± 0.3 |
|
|
||||
| RUN3785 | MAT-POS-b3e365b9-1_1 |
|
EN300-307084_1_2_1 |
|
−1.2 ± 0.3 |
|
|
||||
| RUN573 | MAT-POS-b3e365b9-1_1 |
|
ADA-UCB-dc2b944c-6_1 |
|
−1.2 ± 0.4 |
|
|
||||
| RUN1633 | MAT-POS-b3e365b9-1_1 |
|
EDG-MED-90036822-77_1 |
|
−1.2 ± 0.3 |
|
|
||||
| RUN3615 | MAT-POS-b3e365b9-1_1 |
|
EN300-783124_3_1_1 |
|
−1.2 ± 0.2 |
|
|
||||