| RUN | Initial microstate | Final microstate | ΔΔG / kcal M-1 | Work distribution | Convergence | ||||||
|---|---|---|---|---|---|---|---|---|---|---|---|
| RUN1699 | MAT-POS-b3e365b9-1_1 |
|
EDG-MED-90036822-109_4 |
|
0.3 ± 0.4 |
|
|
||||
| RUN5769 | MAT-POS-b3e365b9-1_1 |
|
EN300-169955_1_3_1 |
|
0.3 ± 0.3 |
|
|
||||
| RUN7568 | MAT-POS-b3e365b9-1_1 |
|
EN300-226776_2_1_1 |
|
0.3 ± 0.4 |
|
|
||||
| RUN7267 | MAT-POS-b3e365b9-1_1 |
|
EN300-00903_2_1_2 |
|
0.3 ± 0.5 |
|
|
||||
| RUN2523 | MAT-POS-b3e365b9-1_1 |
|
EDG-MED-ba1ac7b9-11_2 |
|
0.3 ± 0.5 |
|
|
||||
| RUN3875 | MAT-POS-b3e365b9-1_1 |
|
EN300-248526_2_1_1 |
|
0.3 ± 0.4 |
|
|
||||
| RUN7168 | MAT-POS-b3e365b9-1_1 |
|
EN300-222145_2_1_1 |
|
0.3 ± 0.3 |
|
|
||||
| RUN5918 | MAT-POS-b3e365b9-1_1 |
|
EN300-66461_2_1_1 |
|
0.3 ± 0.2 |
|
|
||||
| RUN1799 | MAT-POS-b3e365b9-1_1 |
|
EDG-MED-90036822-110_1 |
|
0.3 ± 0.3 |
|
|
||||
| RUN5750 | MAT-POS-b3e365b9-1_1 |
|
EN300-1667046_1_1_1 |
|
0.3 ± 0.3 |
|
|
||||
| RUN3351 | MAT-POS-b3e365b9-1_1 |
|
EN300-93174_1_1_1 |
|
0.3 ± 0.3 |
|
|
||||
| RUN4989 | MAT-POS-b3e365b9-1_1 |
|
EN300-3143295_1_1_1 |
|
0.3 ± 0.2 |
|
|
||||
| RUN6416 | MAT-POS-b3e365b9-1_1 |
|
EN300-08705_1_1_1 |
|
0.3 ± 0.3 |
|
|
||||
| RUN7492 | MAT-POS-b3e365b9-1_1 |
|
EN300-100271_1_1_1 |
|
0.3 ± 0.3 |
|
|
||||
| RUN1084 | MAT-POS-b3e365b9-1_1 |
|
JOH-UNI-6fede743-2_1 |
|
0.3 ± 0.4 |
|
|
||||
| RUN2021 | MAT-POS-b3e365b9-1_1 |
|
LEE-CAM-7ab9b158-1_4 |
|
0.3 ± 0.4 |
|
|
||||
| RUN5143 | MAT-POS-b3e365b9-1_1 |
|
EN300-45049_3_1_1 |
|
0.3 ± 0.3 |
|
|
||||
| RUN4405 | MAT-POS-b3e365b9-1_1 |
|
EN300-6759637_1_1_1 |
|
0.3 ± 0.3 |
|
|
||||
| RUN6666 | MAT-POS-b3e365b9-1_1 |
|
EN300-170715_1_1_1 |
|
0.3 ± 0.3 |
|
|
||||
| RUN6930 | MAT-POS-b3e365b9-1_1 |
|
EN300-199449_1_3_1 |
|
0.3 ± 0.3 |
|
|
||||
| RUN7074 | MAT-POS-b3e365b9-1_1 |
|
EN300-46832_4_2_1 |
|
0.3 ± 0.4 |
|
|
||||
| RUN2076 | MAT-POS-b3e365b9-1_1 |
|
ALP-UNI-76695c4f-9_1 |
|
0.3 ± 0.4 |
|
|
||||
| RUN2580 | MAT-POS-b3e365b9-1_1 |
|
EDG-MED-ba1ac7b9-31_3 |
|
0.3 ± 0.4 |
|
|
||||
| RUN6727 | MAT-POS-b3e365b9-1_1 |
|
EN300-6974806_4_1_1 |
|
0.3 ± 0.5 |
|
|
||||
| RUN31 | MAT-POS-b3e365b9-1_1 |
|
PET-UNK-c9c1e0d8-4_1 |
|
0.3 ± 0.3 |
|
|
||||
| RUN7346 | MAT-POS-b3e365b9-1_1 |
|
EN300-246747_2_1_1 |
|
0.3 ± 0.3 |
|
|
||||
| RUN7672 | MAT-POS-b3e365b9-1_1 |
|
EN300-252113_1_2_1 |
|
0.3 ± 0.4 |
|
|
||||
| RUN7432 | MAT-POS-b3e365b9-1_1 |
|
EN300-50488_1_1_1 |
|
0.3 ± 0.3 |
|
|
||||
| RUN7082 | MAT-POS-b3e365b9-1_1 |
|
EN300-7438575_2_2_1 |
|
0.3 ± 0.3 |
|
|
||||
| RUN6821 | MAT-POS-b3e365b9-1_1 |
|
EN300-92406_1_1_1 |
|
0.3 ± 0.3 |
|
|
||||
| RUN1983 | MAT-POS-b3e365b9-1_1 |
|
KAD-UNI-8a629cb0-44_1 |
|
0.3 ± 0.4 |
|
|
||||
| RUN6485 | MAT-POS-b3e365b9-1_1 |
|
EN300-332601_3_1_1 |
|
0.3 ± 0.3 |
|
|
||||
| RUN702 | MAT-POS-b3e365b9-1_1 |
|
DAR-DIA-0d514e7d-11_1 |
|
0.3 ± 0.2 |
|
|
||||
| RUN6126 | MAT-POS-b3e365b9-1_1 |
|
EN300-7443668_1_1_1 |
|
0.3 ± 0.3 |
|
|
||||
| RUN3560 | MAT-POS-b3e365b9-1_1 |
|
EN300-180532_1_1_1 |
|
0.3 ± 0.5 |
|
|
||||
| RUN6365 | MAT-POS-b3e365b9-1_1 |
|
EN300-261859_2_1_2 |
|
0.3 ± 0.2 |
|
|
||||
| RUN738 | MAT-POS-b3e365b9-1_1 |
|
MIC-UNK-5a93dd5f-12_1 |
|
0.3 ± 0.5 |
|
|
||||
| RUN2378 | MAT-POS-b3e365b9-1_1 |
|
ALP-UNI-3496895b-2_5 |
|
0.3 ± 0.5 |
|
|
||||
| RUN1810 | MAT-POS-b3e365b9-1_1 |
|
RAL-THA-2d450e86-9_1 |
|
0.3 ± 0.2 |
|
|
||||
| RUN6702 | MAT-POS-b3e365b9-1_1 |
|
EN300-214189_1_1_1 |
|
0.3 ± 0.3 |
|
|
||||
| RUN5761 | MAT-POS-b3e365b9-1_1 |
|
EN300-383904_1_1_1 |
|
0.3 ± 0.3 |
|
|
||||
| RUN6716 | MAT-POS-b3e365b9-1_1 |
|
EN300-15368_1_1_1 |
|
0.3 ± 0.3 |
|
|
||||
| RUN4826 | MAT-POS-b3e365b9-1_1 |
|
EN300-1265071_2_1_1 |
|
0.3 ± 0.3 |
|
|
||||
| RUN6933 | MAT-POS-b3e365b9-1_1 |
|
EN300-4698402_2_1_1 |
|
0.3 ± 0.2 |
|
|
||||
| RUN1690 | MAT-POS-b3e365b9-1_1 |
|
EDG-MED-90036822-89_2 |
|
0.3 ± 0.3 |
|
|
||||
| RUN6223 | MAT-POS-b3e365b9-1_1 |
|
EN300-72272_2_1_1 |
|
0.3 ± 0.2 |
|
|
||||
| RUN6022 | MAT-POS-b3e365b9-1_1 |
|
EN300-39405_1_1_1 |
|
0.3 ± 0.3 |
|
|
||||
| RUN4546 | MAT-POS-b3e365b9-1_1 |
|
EN300-304378_1_1_1 |
|
0.3 ± 0.3 |
|
|
||||
| RUN1425 | MAT-POS-b3e365b9-1_1 |
|
ED_-GRI-5b13fbe2-50_1 |
|
0.3 ± 0.3 |
|
|
||||
| RUN756 | MAT-POS-b3e365b9-1_1 |
|
DAR-DIA-0d514e7d-7_1 |
|
0.3 ± 0.1 |
|
|
||||
| RUN416 | MAT-POS-b3e365b9-1_1 |
|
MAT-POS-0c8fa4a7-1_1 |
|
0.3 ± 0.2 |
|
|
||||
| RUN5035 | MAT-POS-b3e365b9-1_1 |
|
EN300-104592_3_2_1 |
|
0.3 ± 0.4 |
|
|
||||
| RUN5497 | MAT-POS-b3e365b9-1_1 |
|
EN300-132615_2_2_1 |
|
0.3 ± 0.4 |
|
|
||||
| RUN3585 | MAT-POS-b3e365b9-1_1 |
|
EN300-91609_1_3_1 |
|
0.3 ± 0.3 |
|
|
||||
| RUN5983 | MAT-POS-b3e365b9-1_1 |
|
EN300-31185_1_1_1 |
|
0.3 ± 0.3 |
|
|
||||
| RUN7776 | MAT-POS-b3e365b9-1_1 |
|
EN300-239233_2_1_1 |
|
0.3 ± 0.2 |
|
|
||||
| RUN6962 | MAT-POS-b3e365b9-1_1 |
|
EN300-7003350_2_1_1 |
|
0.3 ± 0.2 |
|
|
||||
| RUN6393 | MAT-POS-b3e365b9-1_1 |
|
EN300-50639_1_1_1 |
|
0.3 ± 0.3 |
|
|
||||
| RUN1516 | MAT-POS-b3e365b9-1_1 |
|
ED_-GRI-5b13fbe2-58_1 |
|
0.3 ± 0.4 |
|
|
||||
| RUN6484 | MAT-POS-b3e365b9-1_1 |
|
EN300-190026_2_3_1 |
|
0.3 ± 0.3 |
|
|
||||
| RUN5007 | MAT-POS-b3e365b9-1_1 |
|
EN300-02015_3_1_1 |
|
0.3 ± 0.3 |
|
|
||||
| RUN5311 | MAT-POS-b3e365b9-1_1 |
|
EN300-36855_1_1_2 |
|
0.3 ± 0.2 |
|
|
||||
| RUN1407 | MAT-POS-b3e365b9-1_1 |
|
ED_-GRI-5b13fbe2-2_2 |
|
0.3 ± 0.4 |
|
|
||||
| RUN1163 | MAT-POS-b3e365b9-1_1 |
|
RAL-THA-8416115c-5_1 |
|
0.3 ± 0.3 |
|
|
||||
| RUN528 | MAT-POS-b3e365b9-1_1 |
|
MIC-UNK-bcd487e9-4_1 |
|
0.3 ± 0.4 |
|
|
||||
| RUN7261 | MAT-POS-b3e365b9-1_1 |
|
EN300-295905_1_3_1 |
|
0.3 ± 0.3 |
|
|
||||
| RUN5394 | MAT-POS-b3e365b9-1_1 |
|
EN300-214038_1_1_1 |
|
0.3 ± 0.4 |
|
|
||||
| RUN7597 | MAT-POS-b3e365b9-1_1 |
|
EN300-1708882_4_1_1 |
|
0.3 ± 0.4 |
|
|
||||
| RUN7378 | MAT-POS-b3e365b9-1_1 |
|
EN300-716218_1_1_1 |
|
0.3 ± 0.4 |
|
|
||||
| RUN7366 | MAT-POS-b3e365b9-1_1 |
|
EN300-866702_1_1_1 |
|
0.3 ± 0.3 |
|
|
||||
| RUN6088 | MAT-POS-b3e365b9-1_1 |
|
EN300-07127_2_2_1 |
|
0.3 ± 0.3 |
|
|
||||
| RUN2362 | MAT-POS-b3e365b9-1_1 |
|
EDJ-MED-40433386-5_1 |
|
0.3 ± 0.3 |
|
|
||||
| RUN7746 | MAT-POS-b3e365b9-1_1 |
|
EN300-624143_2_1_1 |
|
0.3 ± 0.2 |
|
|
||||
| RUN479 | MAT-POS-b3e365b9-1_1 |
|
MIC-UNK-cdc2493e-21_1 |
|
0.3 ± 0.6 |
|
|
||||
| RUN7165 | MAT-POS-b3e365b9-1_1 |
|
EN300-1709101_2_1_1 |
|
0.3 ± 0.2 |
|
|
||||
| RUN7320 | MAT-POS-b3e365b9-1_1 |
|
EN300-108507_1_2_1 |
|
0.3 ± 0.3 |
|
|
||||
| RUN6799 | MAT-POS-b3e365b9-1_1 |
|
EN300-6737762_3_2_1 |
|
0.3 ± 0.3 |
|
|
||||
| RUN296 | MAT-POS-b3e365b9-1_1 |
|
MAT-POS-8a69d52e-4_1 |
|
0.3 ± 0.2 |
|
|
||||
| RUN5253 | MAT-POS-b3e365b9-1_1 |
|
EN300-59386_1_1_1 |
|
0.3 ± 0.3 |
|
|
||||
| RUN1540 | MAT-POS-b3e365b9-1_1 |
|
EDG-MED-4c68219f-13_1 |
|
0.3 ± 0.4 |
|
|
||||
| RUN2651 | MAT-POS-b3e365b9-1_1 |
|
EDJ-MED-ee07cf00-14_1 |
|
0.3 ± 0.5 |
|
|
||||
| RUN7584 | MAT-POS-b3e365b9-1_1 |
|
EN300-1968342_4_1_1 |
|
0.3 ± 0.3 |
|
|
||||
| RUN1997 | MAT-POS-b3e365b9-1_1 |
|
MAT-POS-89e65850-1_2 |
|
0.3 ± 0.3 |
|
|
||||
| RUN5377 | MAT-POS-b3e365b9-1_1 |
|
EN300-74965_1_1_1 |
|
0.3 ± 0.3 |
|
|
||||
| RUN593 | MAT-POS-b3e365b9-1_1 |
|
MAK-UNK-ffc90da7-2_3 |
|
0.3 ± 0.3 |
|
|
||||
| RUN826 | MAT-POS-b3e365b9-1_1 |
|
MAK-UNK-c749d764-2_5 |
|
0.3 ± 0.4 |
|
|
||||
| RUN466 | MAT-POS-b3e365b9-1_1 |
|
MIC-UNK-cdc2493e-8_6 |
|
0.3 ± 0.4 |
|
|
||||
| RUN6992 | MAT-POS-b3e365b9-1_1 |
|
EN300-181492_4_2_1 |
|
0.3 ± 0.4 |
|
|
||||
| RUN6356 | MAT-POS-b3e365b9-1_1 |
|
EN300-122319_2_1_1 |
|
0.3 ± 0.2 |
|
|
||||
| RUN6329 | MAT-POS-b3e365b9-1_1 |
|
EN300-201346_2_2_1 |
|
0.3 ± 0.2 |
|
|
||||
| RUN2024 | MAT-POS-b3e365b9-1_1 |
|
LEE-CAM-7ab9b158-1_8 |
|
0.3 ± 0.4 |
|
|
||||
| RUN3684 | MAT-POS-b3e365b9-1_1 |
|
EN300-6743783_1_1_1 |
|
0.3 ± 0.4 |
|
|
||||
| RUN285 | MAT-POS-b3e365b9-1_1 |
|
VLA-UCB-05e51b3f-15_1 |
|
0.3 ± 0.4 |
|
|
||||
| RUN6426 | MAT-POS-b3e365b9-1_1 |
|
EN300-360157_3_1_1 |
|
0.3 ± 0.3 |
|
|
||||
| RUN4729 | MAT-POS-b3e365b9-1_1 |
|
EN300-202922_2_1_1 |
|
0.3 ± 0.3 |
|
|
||||
| RUN3728 | MAT-POS-b3e365b9-1_1 |
|
EN300-303908_1_1_1 |
|
0.3 ± 0.2 |
|
|
||||
| RUN2545 | MAT-POS-b3e365b9-1_1 |
|
EDG-MED-ba1ac7b9-25_6 |
|
0.3 ± 0.6 |
|
|
||||
| RUN7587 | MAT-POS-b3e365b9-1_1 |
|
EN300-704039_1_3_1 |
|
0.3 ± 0.4 |
|
|
||||
| RUN5561 | MAT-POS-b3e365b9-1_1 |
|
EN300-102864_3_1_1 |
|
0.3 ± 0.3 |
|
|
||||
| RUN1304 | MAT-POS-b3e365b9-1_1 |
|
BEN-DND-a7517465-5_1 |
|
0.32 ± 0.04 |
|
|
||||