| RUN | Initial microstate | Final microstate | ΔΔG / kcal M-1 | Work distribution | Convergence | ||||||
|---|---|---|---|---|---|---|---|---|---|---|---|
| RUN6499 | MAT-POS-b3e365b9-1_1 |
|
EN300-817777_2_1_1 |
|
−0.2 ± 0.3 |
|
|
||||
| RUN6396 | MAT-POS-b3e365b9-1_1 |
|
EN300-1264816_1_2_1 |
|
−0.2 ± 0.3 |
|
|
||||
| RUN7198 | MAT-POS-b3e365b9-1_1 |
|
EN300-65115_2_1_1 |
|
−0.2 ± 0.3 |
|
|
||||
| RUN7228 | MAT-POS-b3e365b9-1_1 |
|
EN300-99391_4_1_1 |
|
−0.2 ± 0.3 |
|
|
||||
| RUN6231 | MAT-POS-b3e365b9-1_1 |
|
EN300-188217_1_1_1 |
|
−0.2 ± 0.3 |
|
|
||||
| RUN7292 | MAT-POS-b3e365b9-1_1 |
|
EN300-43090_1_1_1 |
|
−0.2 ± 0.3 |
|
|
||||
| RUN5600 | MAT-POS-b3e365b9-1_1 |
|
EN300-1387145_3_4_1 |
|
−0.2 ± 0.4 |
|
|
||||
| RUN43 | MAT-POS-b3e365b9-1_1 |
|
ALP-POS-3b848b35-2_1 |
|
−0.2 ± 0.4 |
|
|
||||
| RUN1333 | MAT-POS-b3e365b9-1_1 |
|
DAR-DIA-9e4459de-13_2 |
|
−0.2 ± 0.4 |
|
|
||||
| RUN1711 | MAT-POS-b3e365b9-1_1 |
|
JOH-UNI-ee5ed7c8-6_1 |
|
−0.2 ± 0.3 |
|
|
||||
| RUN414 | MAT-POS-b3e365b9-1_1 |
|
MAK-UNK-8be7dca9-3_2 |
|
−0.2 ± 0.1 |
|
|
||||
| RUN5324 | MAT-POS-b3e365b9-1_1 |
|
EN300-220194_1_1_1 |
|
−0.2 ± 0.3 |
|
|
||||
| RUN1992 | MAT-POS-b3e365b9-1_1 |
|
KAD-UNI-8a629cb0-22_1 |
|
−0.2 ± 0.3 |
|
|
||||
| RUN7546 | MAT-POS-b3e365b9-1_1 |
|
EN300-52009_4_1_1 |
|
−0.2 ± 0.3 |
|
|
||||
| RUN1047 | MAT-POS-b3e365b9-1_1 |
|
JOH-SUS-a69c159d-2_1 |
|
−0.22 ± 0.05 |
|
|
||||
| RUN6431 | MAT-POS-b3e365b9-1_1 |
|
EN300-75342_1_1_1 |
|
−0.2 ± 0.2 |
|
|
||||
| RUN5916 | MAT-POS-b3e365b9-1_1 |
|
EN300-7353672_1_4_1 |
|
−0.2 ± 0.4 |
|
|
||||
| RUN6488 | MAT-POS-b3e365b9-1_1 |
|
EN300-783124_3_2_1 |
|
−0.2 ± 0.3 |
|
|
||||
| RUN353 | MAT-POS-b3e365b9-1_1 |
|
VLA-UCB-05e51b3f-12_2 |
|
−0.2 ± 0.4 |
|
|
||||
| RUN7635 | MAT-POS-b3e365b9-1_1 |
|
EN300-1707870_1_1_1 |
|
−0.2 ± 0.4 |
|
|
||||
| RUN4774 | MAT-POS-b3e365b9-1_1 |
|
EN300-1072199_2_2_1 |
|
−0.2 ± 0.3 |
|
|
||||
| RUN1737 | MAT-POS-b3e365b9-1_1 |
|
EDG-MED-90036822-92_1 |
|
−0.2 ± 0.3 |
|
|
||||
| RUN6164 | MAT-POS-b3e365b9-1_1 |
|
EN300-68889_3_1_1 |
|
−0.2 ± 0.3 |
|
|
||||
| RUN1043 | MAT-POS-b3e365b9-1_1 |
|
JOH-SUS-a69c159d-5_1 |
|
−0.21 ± 0.05 |
|
|
||||
| RUN1790 | MAT-POS-b3e365b9-1_1 |
|
ALP-UNI-3735e77e-4_1 |
|
−0.2 ± 0.3 |
|
|
||||
| RUN2155 | MAT-POS-b3e365b9-1_1 |
|
MAT-POS-1f3f1a6f-4_2 |
|
−0.2 ± 0.4 |
|
|
||||
| RUN1523 | MAT-POS-b3e365b9-1_1 |
|
ED_-GRI-5b13fbe2-54_1 |
|
−0.2 ± 0.4 |
|
|
||||
| RUN6868 | MAT-POS-b3e365b9-1_1 |
|
EN300-84785_1_1_1 |
|
−0.2 ± 0.3 |
|
|
||||
| RUN7511 | MAT-POS-b3e365b9-1_1 |
|
ALP-POS-696356e4-1_1_1 |
|
−0.21 ± 0.04 |
|
|
||||
| RUN3742 | MAT-POS-b3e365b9-1_1 |
|
EN300-7431629_1_1_1 |
|
−0.2 ± 0.3 |
|
|
||||
| RUN5803 | MAT-POS-b3e365b9-1_1 |
|
EN300-7121836_2_1_1 |
|
−0.2 ± 0.2 |
|
|
||||
| RUN4134 | MAT-POS-b3e365b9-1_1 |
|
EN300-42819_3_1_1 |
|
−0.2 ± 0.2 |
|
|
||||
| RUN4489 | MAT-POS-b3e365b9-1_1 |
|
EN300-1707774_1_1_1 |
|
−0.2 ± 0.2 |
|
|
||||
| RUN1630 | MAT-POS-b3e365b9-1_1 |
|
EDG-MED-90036822-74_1 |
|
−0.2 ± 0.2 |
|
|
||||
| RUN7294 | MAT-POS-b3e365b9-1_1 |
|
EN300-212266_3_1_1 |
|
−0.2 ± 0.4 |
|
|
||||
| RUN5953 | MAT-POS-b3e365b9-1_1 |
|
EN300-82616_3_1_1 |
|
−0.2 ± 0.3 |
|
|
||||
| RUN5973 | MAT-POS-b3e365b9-1_1 |
|
EN300-31242_4_1_1 |
|
−0.2 ± 0.3 |
|
|
||||
| RUN6524 | MAT-POS-b3e365b9-1_1 |
|
EN300-208959_1_1_1 |
|
−0.2 ± 0.3 |
|
|
||||
| RUN6555 | MAT-POS-b3e365b9-1_1 |
|
EN300-1644703_1_1_1 |
|
−0.2 ± 0.2 |
|
|
||||
| RUN3966 | MAT-POS-b3e365b9-1_1 |
|
EN300-7457160_3_1_1 |
|
−0.2 ± 0.4 |
|
|
||||
| RUN796 | MAT-POS-b3e365b9-1_1 |
|
DAR-DIA-0d514e7d-16_1 |
|
−0.2 ± 0.2 |
|
|
||||
| RUN5707 | MAT-POS-b3e365b9-1_1 |
|
EN300-314088_1_1_1 |
|
−0.2 ± 0.3 |
|
|
||||
| RUN141 | MAT-POS-b3e365b9-1_1 |
|
MIC-UNK-d36ab305-4_2 |
|
−0.2 ± 0.4 |
|
|
||||
| RUN2739 | MAT-POS-b3e365b9-1_1 |
|
EN300-14752_1_1_1 |
|
−0.2 ± 0.2 |
|
|
||||
| RUN6979 | MAT-POS-b3e365b9-1_1 |
|
EN300-7444533_4_2_1 |
|
−0.2 ± 0.3 |
|
|
||||
| RUN5283 | MAT-POS-b3e365b9-1_1 |
|
EN300-28177_2_1_1 |
|
−0.2 ± 0.4 |
|
|
||||
| RUN2610 | MAT-POS-b3e365b9-1_1 |
|
ALP-UNI-dbbfd3db-10_1 |
|
−0.2 ± 0.3 |
|
|
||||
| RUN6303 | MAT-POS-b3e365b9-1_1 |
|
EN300-7444316_1_1_1 |
|
−0.2 ± 0.4 |
|
|
||||
| RUN4253 | MAT-POS-b3e365b9-1_1 |
|
EN300-10397_2_1_1 |
|
−0.2 ± 0.2 |
|
|
||||
| RUN7700 | MAT-POS-b3e365b9-1_1 |
|
EN300-55744_1_1_1 |
|
−0.2 ± 0.3 |
|
|
||||
| RUN4015 | MAT-POS-b3e365b9-1_1 |
|
EN300-314274_1_1_1 |
|
−0.2 ± 0.3 |
|
|
||||
| RUN7310 | MAT-POS-b3e365b9-1_1 |
|
EN300-861925_2_1_1 |
|
−0.2 ± 0.2 |
|
|
||||
| RUN5257 | MAT-POS-b3e365b9-1_1 |
|
EN300-35789_3_1_1 |
|
−0.2 ± 0.3 |
|
|
||||
| RUN2221 | MAT-POS-b3e365b9-1_1 |
|
MAT-POS-f9802937-4_1 |
|
−0.2 ± 0.2 |
|
|
||||
| RUN4278 | MAT-POS-b3e365b9-1_1 |
|
EN300-62074_1_1_1 |
|
−0.2 ± 0.3 |
|
|
||||
| RUN5563 | MAT-POS-b3e365b9-1_1 |
|
EN300-103187_1_1_1 |
|
−0.2 ± 0.2 |
|
|
||||
| RUN6682 | MAT-POS-b3e365b9-1_1 |
|
EN300-14458_4_2_1 |
|
−0.2 ± 0.3 |
|
|
||||
| RUN7371 | MAT-POS-b3e365b9-1_1 |
|
EN300-7375395_2_1_1 |
|
−0.2 ± 0.3 |
|
|
||||
| RUN6842 | MAT-POS-b3e365b9-1_1 |
|
EN300-651177_1_1_1 |
|
−0.2 ± 0.4 |
|
|
||||
| RUN5698 | MAT-POS-b3e365b9-1_1 |
|
EN300-6745081_1_2_1 |
|
−0.2 ± 0.3 |
|
|
||||
| RUN6875 | MAT-POS-b3e365b9-1_1 |
|
EN300-39305_3_1_1 |
|
−0.2 ± 0.3 |
|
|
||||
| RUN7539 | MAT-POS-b3e365b9-1_1 |
|
EN300-175186_1_2_1 |
|
−0.2 ± 0.3 |
|
|
||||
| RUN4566 | MAT-POS-b3e365b9-1_1 |
|
EN300-252683_1_1_1 |
|
−0.2 ± 0.3 |
|
|
||||
| RUN5524 | MAT-POS-b3e365b9-1_1 |
|
ALP-POS-d3acb8cc-1_1_1 |
|
−0.20 ± 0.09 |
|
|
||||
| RUN6092 | MAT-POS-b3e365b9-1_1 |
|
EN300-17381_2_1_1 |
|
−0.2 ± 0.2 |
|
|
||||
| RUN7284 | MAT-POS-b3e365b9-1_1 |
|
EN300-130644_1_1_1 |
|
−0.2 ± 0.3 |
|
|
||||
| RUN7014 | MAT-POS-b3e365b9-1_1 |
|
EN300-102347_1_1_1 |
|
−0.2 ± 0.2 |
|
|
||||
| RUN295 | MAT-POS-b3e365b9-1_1 |
|
VLA-UCB-05e51b3f-14_1 |
|
−0.2 ± 0.3 |
|
|
||||
| RUN3104 | MAT-POS-b3e365b9-1_1 |
|
EN300-4293814_3_1_1 |
|
−0.2 ± 0.5 |
|
|
||||
| RUN7675 | MAT-POS-b3e365b9-1_1 |
|
EN300-1605566_1_2_1 |
|
−0.2 ± 0.3 |
|
|
||||
| RUN4457 | MAT-POS-b3e365b9-1_1 |
|
EN300-52325_3_1_1 |
|
−0.2 ± 0.5 |
|
|
||||
| RUN5475 | MAT-POS-b3e365b9-1_1 |
|
EN300-1387145_3_1_1 |
|
−0.2 ± 0.3 |
|
|
||||
| RUN1309 | MAT-POS-b3e365b9-1_1 |
|
DAR-DIA-076fb6ea-12_1 |
|
−0.2 ± 0.6 |
|
|
||||
| RUN7750 | MAT-POS-b3e365b9-1_1 |
|
EN300-312662_1_1_1 |
|
−0.2 ± 0.4 |
|
|
||||
| RUN6723 | MAT-POS-b3e365b9-1_1 |
|
EN300-46832_2_1_1 |
|
−0.2 ± 0.3 |
|
|
||||
| RUN6115 | MAT-POS-b3e365b9-1_1 |
|
EN300-104395_4_1_1 |
|
−0.2 ± 0.3 |
|
|
||||
| RUN6892 | MAT-POS-b3e365b9-1_1 |
|
DAR-DIA-6a508060-3_1_1 |
|
−0.19 ± 0.05 |
|
|
||||
| RUN781 | MAT-POS-b3e365b9-1_1 |
|
DAR-DIA-0d514e7d-32_29 |
|
−0.2 ± 0.2 |
|
|
||||
| RUN4971 | MAT-POS-b3e365b9-1_1 |
|
EN300-2007648_2_1_1 |
|
−0.2 ± 0.3 |
|
|
||||
| RUN1315 | MAT-POS-b3e365b9-1_1 |
|
DAR-DIA-9e4459de-11_5 |
|
−0.2 ± 0.4 |
|
|
||||
| RUN4750 | MAT-POS-b3e365b9-1_1 |
|
EN300-194442_1_2_1 |
|
−0.2 ± 0.4 |
|
|
||||
| RUN6359 | MAT-POS-b3e365b9-1_1 |
|
EN300-110423_2_1_1 |
|
−0.2 ± 0.2 |
|
|
||||
| RUN4975 | MAT-POS-b3e365b9-1_1 |
|
EN300-212814_1_2_1 |
|
−0.2 ± 0.4 |
|
|
||||
| RUN4744 | MAT-POS-b3e365b9-1_1 |
|
EN300-37195_3_1_1 |
|
−0.2 ± 0.3 |
|
|
||||
| RUN3750 | MAT-POS-b3e365b9-1_1 |
|
EN300-19542_4_2_1 |
|
−0.2 ± 0.3 |
|
|
||||
| RUN1694 | MAT-POS-b3e365b9-1_1 |
|
EDG-MED-90036822-107_1 |
|
−0.2 ± 0.2 |
|
|
||||
| RUN4158 | MAT-POS-b3e365b9-1_1 |
|
EN300-366468_1_1_1 |
|
−0.2 ± 0.2 |
|
|
||||
| RUN1638 | MAT-POS-b3e365b9-1_1 |
|
EDG-MED-90036822-52_1 |
|
−0.2 ± 0.3 |
|
|
||||
| RUN7716 | MAT-POS-b3e365b9-1_1 |
|
EN300-310254_1_2_1 |
|
−0.2 ± 0.5 |
|
|
||||
| RUN633 | MAT-POS-b3e365b9-1_1 |
|
MAK-UNK-ffc90da7-3_1 |
|
−0.2 ± 0.3 |
|
|
||||
| RUN4707 | MAT-POS-b3e365b9-1_1 |
|
EN300-01527_4_1_1 |
|
−0.2 ± 0.3 |
|
|
||||
| RUN1120 | MAT-POS-b3e365b9-1_1 |
|
RAL-THA-4aa06b95-1_1 |
|
−0.2 ± 0.3 |
|
|
||||
| RUN372 | MAT-POS-b3e365b9-1_1 |
|
DAR-DIA-23e5a6a0-4_2 |
|
−0.2 ± 0.3 |
|
|
||||
| RUN5342 | MAT-POS-b3e365b9-1_1 |
|
EN300-36855_1_1_1 |
|
−0.2 ± 0.3 |
|
|
||||
| RUN1778 | MAT-POS-b3e365b9-1_1 |
|
JOH-UNI-3fc3434e-7_2 |
|
−0.2 ± 0.2 |
|
|
||||
| RUN6458 | MAT-POS-b3e365b9-1_1 |
|
EN300-7353973_1_1_1 |
|
−0.2 ± 0.3 |
|
|
||||
| RUN3659 | MAT-POS-b3e365b9-1_1 |
|
EN300-761220_3_1_1 |
|
−0.2 ± 0.3 |
|
|
||||
| RUN1408 | MAT-POS-b3e365b9-1_1 |
|
ED_-GRI-5b13fbe2-8_1 |
|
−0.2 ± 0.7 |
|
|
||||
| RUN5724 | MAT-POS-b3e365b9-1_1 |
|
EN300-7471076_1_4_1 |
|
−0.2 ± 0.2 |
|
|
||||
| RUN1169 | MAT-POS-b3e365b9-1_1 |
|
RAL-THA-4aa06b95-5_2 |
|
−0.2 ± 0.3 |
|
|
||||