| RUN | Initial microstate | Final microstate | ΔΔG / kcal M-1 | Work distribution | Convergence | ||||||
|---|---|---|---|---|---|---|---|---|---|---|---|
| RUN7541 | MAT-POS-b3e365b9-1_1 |
|
EN300-66518_1_1_1 |
|
−0.8 ± 0.3 |
|
|
||||
| RUN3880 | MAT-POS-b3e365b9-1_1 |
|
EN300-43206_1_1_1 |
|
−0.8 ± 0.3 |
|
|
||||
| RUN1166 | MAT-POS-b3e365b9-1_1 |
|
MIC-UNK-45817b9b-1_1 |
|
−0.8 ± 0.3 |
|
|
||||
| RUN7538 | MAT-POS-b3e365b9-1_1 |
|
EN300-6493060_1_1_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN6644 | MAT-POS-b3e365b9-1_1 |
|
EN300-6501360_2_1_1 |
|
−0.7 ± 0.4 |
|
|
||||
| RUN7770 | MAT-POS-b3e365b9-1_1 |
|
EN300-318341_2_1_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN2028 | MAT-POS-b3e365b9-1_1 |
|
KAD-UNI-8a629cb0-47_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN1980 | MAT-POS-b3e365b9-1_1 |
|
KAD-UNI-8a629cb0-44_2 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN2487 | MAT-POS-b3e365b9-1_1 |
|
EDG-MED-ba1ac7b9-14_8 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN1990 | MAT-POS-b3e365b9-1_1 |
|
KAD-UNI-8a629cb0-34_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN6625 | MAT-POS-b3e365b9-1_1 |
|
EN300-02067_3_1_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN5711 | MAT-POS-b3e365b9-1_1 |
|
EN300-1600517_1_1_1 |
|
−0.7 ± 0.2 |
|
|
||||
| RUN7686 | MAT-POS-b3e365b9-1_1 |
|
EN300-305282_3_1_1 |
|
−0.7 ± 0.4 |
|
|
||||
| RUN6463 | MAT-POS-b3e365b9-1_1 |
|
EN300-35612_1_1_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN6067 | MAT-POS-b3e365b9-1_1 |
|
EN300-67439_1_1_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN4432 | MAT-POS-b3e365b9-1_1 |
|
EN300-155362_1_4_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN2042 | MAT-POS-b3e365b9-1_1 |
|
KAD-UNI-8a629cb0-38_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN6745 | MAT-POS-b3e365b9-1_1 |
|
EN300-28113_2_2_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN3956 | MAT-POS-b3e365b9-1_1 |
|
EN300-23214_2_2_1 |
|
−0.7 ± 0.4 |
|
|
||||
| RUN6409 | MAT-POS-b3e365b9-1_1 |
|
EN300-68875_3_1_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN4456 | MAT-POS-b3e365b9-1_1 |
|
EN300-1608992_1_1_1 |
|
−0.7 ± 0.2 |
|
|
||||
| RUN6658 | MAT-POS-b3e365b9-1_1 |
|
EN300-249764_1_2_1 |
|
−0.7 ± 0.2 |
|
|
||||
| RUN5745 | MAT-POS-b3e365b9-1_1 |
|
EN300-51257_3_2_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN5338 | MAT-POS-b3e365b9-1_1 |
|
EN300-332838_1_2_1 |
|
−0.7 ± 0.2 |
|
|
||||
| RUN7324 | MAT-POS-b3e365b9-1_1 |
|
EN300-221518_4_1_1 |
|
−0.7 ± 0.4 |
|
|
||||
| RUN516 | MAT-POS-b3e365b9-1_1 |
|
MIC-UNK-bcd487e9-1_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN6998 | MAT-POS-b3e365b9-1_1 |
|
EN300-6746631_1_1_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN3422 | MAT-POS-b3e365b9-1_1 |
|
EN300-128463_4_1_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN4871 | MAT-POS-b3e365b9-1_1 |
|
EN300-4698402_1_1_1 |
|
−0.7 ± 0.2 |
|
|
||||
| RUN4904 | MAT-POS-b3e365b9-1_1 |
|
EN300-255496_3_1_1 |
|
−0.7 ± 0.4 |
|
|
||||
| RUN4982 | MAT-POS-b3e365b9-1_1 |
|
EN300-6736413_4_2_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN7499 | MAT-POS-b3e365b9-1_1 |
|
EN300-6487407_2_1_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN5264 | MAT-POS-b3e365b9-1_1 |
|
EN300-128277_1_1_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN2023 | MAT-POS-b3e365b9-1_1 |
|
ALP-UNI-76695c4f-10_1 |
|
−0.7 ± 0.4 |
|
|
||||
| RUN6147 | MAT-POS-b3e365b9-1_1 |
|
EN300-1179673_3_1_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN6691 | MAT-POS-b3e365b9-1_1 |
|
EN300-103979_1_1_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN6957 | MAT-POS-b3e365b9-1_1 |
|
EN300-333677_1_1_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN7027 | MAT-POS-b3e365b9-1_1 |
|
EN300-1968342_4_1_1 |
|
−0.7 ± 0.4 |
|
|
||||
| RUN5871 | MAT-POS-b3e365b9-1_1 |
|
EN300-123623_1_1_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN6114 | MAT-POS-b3e365b9-1_1 |
|
EN300-126389_1_1_1 |
|
−0.7 ± 0.2 |
|
|
||||
| RUN4139 | MAT-POS-b3e365b9-1_1 |
|
EN300-25960_2_1_1 |
|
−0.7 ± 0.4 |
|
|
||||
| RUN4830 | MAT-POS-b3e365b9-1_1 |
|
EN300-00271_1_2_1 |
|
−0.7 ± 0.2 |
|
|
||||
| RUN6110 | MAT-POS-b3e365b9-1_1 |
|
EN300-6759512_2_1_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN774 | MAT-POS-b3e365b9-1_1 |
|
DAR-DIA-0d514e7d-32_5 |
|
−0.7 ± 0.2 |
|
|
||||
| RUN4390 | MAT-POS-b3e365b9-1_1 |
|
EN300-221518_2_1_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN5500 | MAT-POS-b3e365b9-1_1 |
|
EN300-7463275_1_2_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN4653 | MAT-POS-b3e365b9-1_1 |
|
EN300-146051_1_1_1 |
|
−0.7 ± 0.2 |
|
|
||||
| RUN6036 | MAT-POS-b3e365b9-1_1 |
|
EN300-114593_1_1_1 |
|
−0.7 ± 0.2 |
|
|
||||
| RUN4891 | MAT-POS-b3e365b9-1_1 |
|
EN300-155362_3_4_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN3951 | MAT-POS-b3e365b9-1_1 |
|
EN300-1968342_2_2_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN6173 | MAT-POS-b3e365b9-1_1 |
|
EN300-193679_1_2_1 |
|
−0.7 ± 0.4 |
|
|
||||
| RUN1536 | MAT-POS-b3e365b9-1_1 |
|
EDG-MED-90036822-29_1 |
|
−0.7 ± 0.2 |
|
|
||||
| RUN6643 | MAT-POS-b3e365b9-1_1 |
|
EN300-122849_1_2_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN7761 | MAT-POS-b3e365b9-1_1 |
|
MAK-UNK-8be7dca9-2_1_1 |
|
−0.72 ± 0.08 |
|
|
||||
| RUN6058 | MAT-POS-b3e365b9-1_1 |
|
EN300-60314_1_1_1 |
|
−0.7 ± 0.2 |
|
|
||||
| RUN5278 | MAT-POS-b3e365b9-1_1 |
|
EN300-10729_1_1_1 |
|
−0.7 ± 0.2 |
|
|
||||
| RUN5907 | MAT-POS-b3e365b9-1_1 |
|
EN300-154693_1_1_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN5925 | MAT-POS-b3e365b9-1_1 |
|
EN300-6729572_1_8_1 |
|
−0.7 ± 0.2 |
|
|
||||
| RUN6669 | MAT-POS-b3e365b9-1_1 |
|
EN300-104746_1_2_1 |
|
−0.7 ± 0.2 |
|
|
||||
| RUN5111 | MAT-POS-b3e365b9-1_1 |
|
FRA-DIA-b66f7109-3_1_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN1665 | MAT-POS-b3e365b9-1_1 |
|
EDG-MED-90036822-38_2 |
|
−0.7 ± 0.4 |
|
|
||||
| RUN1584 | MAT-POS-b3e365b9-1_1 |
|
EDG-MED-90036822-26_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN3273 | MAT-POS-b3e365b9-1_1 |
|
EN300-365993_1_4_1 |
|
−0.7 ± 0.4 |
|
|
||||
| RUN5458 | MAT-POS-b3e365b9-1_1 |
|
EN300-741926_1_1_1 |
|
−0.7 ± 0.2 |
|
|
||||
| RUN3501 | MAT-POS-b3e365b9-1_1 |
|
DAR-DIA-5ff57136-18_1_1 |
|
−0.7 ± 0.1 |
|
|
||||
| RUN4007 | MAT-POS-b3e365b9-1_1 |
|
EN300-36855_3_1_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN6144 | MAT-POS-b3e365b9-1_1 |
|
EN300-66764_1_4_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN5071 | MAT-POS-b3e365b9-1_1 |
|
EN300-312450_1_1_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN6500 | MAT-POS-b3e365b9-1_1 |
|
EN300-366278_2_1_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN7415 | MAT-POS-b3e365b9-1_1 |
|
EN300-33478_3_1_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN4102 | MAT-POS-b3e365b9-1_1 |
|
EN300-1654606_2_1_1 |
|
−0.7 ± 0.2 |
|
|
||||
| RUN6318 | MAT-POS-b3e365b9-1_1 |
|
EN300-1588613_3_2_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN3917 | MAT-POS-b3e365b9-1_1 |
|
EN300-253462_3_1_1 |
|
−0.7 ± 0.4 |
|
|
||||
| RUN2094 | MAT-POS-b3e365b9-1_1 |
|
MAT-POS-de59a476-6_2 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN7399 | MAT-POS-b3e365b9-1_1 |
|
EN300-7432302_2_1_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN6195 | MAT-POS-b3e365b9-1_1 |
|
EN300-65839_2_2_1 |
|
−0.7 ± 0.2 |
|
|
||||
| RUN5982 | MAT-POS-b3e365b9-1_1 |
|
EN300-66082_3_1_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN5116 | MAT-POS-b3e365b9-1_1 |
|
DAR-DIA-0d514e7d-30_1_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN6009 | MAT-POS-b3e365b9-1_1 |
|
EN300-148421_1_1_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN4964 | MAT-POS-b3e365b9-1_1 |
|
EN300-101197_2_1_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN5704 | MAT-POS-b3e365b9-1_1 |
|
EN300-78368_1_1_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN5952 | MAT-POS-b3e365b9-1_1 |
|
EN300-221518_4_1_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN4188 | MAT-POS-b3e365b9-1_1 |
|
EN300-51961_1_1_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN6305 | MAT-POS-b3e365b9-1_1 |
|
EN300-2923949_1_3_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN5162 | MAT-POS-b3e365b9-1_1 |
|
EN300-220194_1_3_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN1498 | MAT-POS-b3e365b9-1_1 |
|
EDG-MED-4c68219f-6_1 |
|
−0.7 ± 0.2 |
|
|
||||
| RUN4426 | MAT-POS-b3e365b9-1_1 |
|
EN300-360157_3_2_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN5292 | MAT-POS-b3e365b9-1_1 |
|
EN300-25572_3_1_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN6400 | MAT-POS-b3e365b9-1_1 |
|
EN300-128715_3_1_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN4202 | MAT-POS-b3e365b9-1_1 |
|
EN300-157776_1_4_1 |
|
−0.7 ± 0.4 |
|
|
||||
| RUN3298 | MAT-POS-b3e365b9-1_1 |
|
EN300-367589_1_1_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN7226 | MAT-POS-b3e365b9-1_1 |
|
EN300-1264816_1_2_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN4794 | MAT-POS-b3e365b9-1_1 |
|
EN300-203293_2_2_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN1462 | MAT-POS-b3e365b9-1_1 |
|
ED_-GRI-5b13fbe2-61_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN5567 | MAT-POS-b3e365b9-1_1 |
|
EN300-1425608_1_4_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN6816 | MAT-POS-b3e365b9-1_1 |
|
EN300-52467_2_1_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN4512 | MAT-POS-b3e365b9-1_1 |
|
EN300-01527_3_2_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN1543 | MAT-POS-b3e365b9-1_1 |
|
EDG-MED-90036822-28_1 |
|
−0.7 ± 0.2 |
|
|
||||
| RUN6049 | MAT-POS-b3e365b9-1_1 |
|
EN300-195756_2_1_1 |
|
−0.7 ± 0.2 |
|
|
||||
| RUN6634 | MAT-POS-b3e365b9-1_1 |
|
EN300-25572_3_2_1 |
|
−0.7 ± 0.3 |
|
|
||||