| RUN | Initial microstate | Final microstate | ΔΔG / kcal M-1 | Work distribution | Convergence | ||||||
|---|---|---|---|---|---|---|---|---|---|---|---|
| RUN3294 | MAT-POS-b3e365b9-1_1 |
|
EN300-103144_4_2_1 |
|
0.7 ± 0.3 |
|
|
||||
| RUN1770 | MAT-POS-b3e365b9-1_1 |
|
JOH-UNI-3fc3434e-11_1 |
|
0.7 ± 0.4 |
|
|
||||
| RUN2092 | MAT-POS-b3e365b9-1_1 |
|
MAT-POS-1f3f1a6f-1_1 |
|
0.7 ± 0.4 |
|
|
||||
| RUN6572 | MAT-POS-b3e365b9-1_1 |
|
EN300-114112_1_1_1 |
|
0.7 ± 0.3 |
|
|
||||
| RUN7012 | MAT-POS-b3e365b9-1_1 |
|
EN300-170715_1_2_1 |
|
0.7 ± 0.3 |
|
|
||||
| RUN337 | MAT-POS-b3e365b9-1_1 |
|
PET-UNK-dd44aeb6-3_1 |
|
0.7 ± 0.3 |
|
|
||||
| RUN3600 | MAT-POS-b3e365b9-1_1 |
|
EN300-343562_1_1_1 |
|
0.7 ± 0.4 |
|
|
||||
| RUN7524 | MAT-POS-b3e365b9-1_1 |
|
EN300-210089_1_2_1 |
|
0.7 ± 0.3 |
|
|
||||
| RUN2377 | MAT-POS-b3e365b9-1_1 |
|
ALP-UNI-3496895b-2_2 |
|
0.7 ± 0.6 |
|
|
||||
| RUN823 | MAT-POS-b3e365b9-1_1 |
|
MAK-UNK-c749d764-4_8 |
|
0.7 ± 0.3 |
|
|
||||
| RUN1602 | MAT-POS-b3e365b9-1_1 |
|
EDG-MED-90036822-74_4 |
|
0.7 ± 0.3 |
|
|
||||
| RUN7403 | MAT-POS-b3e365b9-1_1 |
|
EN300-146174_4_1_1 |
|
0.7 ± 0.4 |
|
|
||||
| RUN7614 | MAT-POS-b3e365b9-1_1 |
|
EN300-6736394_2_1_1 |
|
0.7 ± 0.3 |
|
|
||||
| RUN1328 | MAT-POS-b3e365b9-1_1 |
|
DAR-DIA-9e4459de-13_13 |
|
0.7 ± 0.6 |
|
|
||||
| RUN6598 | MAT-POS-b3e365b9-1_1 |
|
EN300-76541_1_1_1 |
|
0.7 ± 0.5 |
|
|
||||
| RUN6427 | MAT-POS-b3e365b9-1_1 |
|
EN300-1644723_2_4_1 |
|
0.7 ± 0.3 |
|
|
||||
| RUN5477 | MAT-POS-b3e365b9-1_1 |
|
EN300-1273016_2_1_1 |
|
0.7 ± 0.3 |
|
|
||||
| RUN5001 | MAT-POS-b3e365b9-1_1 |
|
EN300-379020_3_1_1 |
|
0.7 ± 0.4 |
|
|
||||
| RUN6725 | MAT-POS-b3e365b9-1_1 |
|
EN300-300217_2_3_1 |
|
0.7 ± 0.3 |
|
|
||||
| RUN6703 | MAT-POS-b3e365b9-1_1 |
|
EN300-269627_1_1_1 |
|
0.7 ± 0.3 |
|
|
||||
| RUN7706 | MAT-POS-b3e365b9-1_1 |
|
EN300-297937_1_1_1 |
|
0.7 ± 0.2 |
|
|
||||
| RUN6374 | MAT-POS-b3e365b9-1_1 |
|
EN300-194172_1_1_1 |
|
0.7 ± 0.3 |
|
|
||||
| RUN2351 | MAT-POS-b3e365b9-1_1 |
|
ALP-UNI-3496895b-2_1 |
|
0.7 ± 0.6 |
|
|
||||
| RUN1057 | MAT-POS-b3e365b9-1_1 |
|
JOH-SUS-a69c159d-6_2 |
|
0.7 ± 0.2 |
|
|
||||
| RUN889 | MAT-POS-b3e365b9-1_1 |
|
MAK-UNK-c749d764-15_7 |
|
0.7 ± 0.6 |
|
|
||||
| RUN6132 | MAT-POS-b3e365b9-1_1 |
|
EN300-82616_4_2_1 |
|
0.7 ± 0.4 |
|
|
||||
| RUN4959 | MAT-POS-b3e365b9-1_1 |
|
EN300-92684_1_1_2 |
|
0.7 ± 0.3 |
|
|
||||
| RUN7302 | MAT-POS-b3e365b9-1_1 |
|
EN300-7444121_2_1_1 |
|
0.7 ± 0.3 |
|
|
||||
| RUN627 | MAT-POS-b3e365b9-1_1 |
|
MIC-UNK-5a93dd5f-1_5 |
|
0.7 ± 0.4 |
|
|
||||
| RUN5135 | MAT-POS-b3e365b9-1_1 |
|
EN300-305996_2_1_1 |
|
0.7 ± 0.2 |
|
|
||||
| RUN581 | MAT-POS-b3e365b9-1_1 |
|
JAG-UCB-706446eb-7_2 |
|
0.7 ± 0.3 |
|
|
||||
| RUN5403 | MAT-POS-b3e365b9-1_1 |
|
EN300-76541_1_4_1 |
|
0.7 ± 0.4 |
|
|
||||
| RUN7101 | MAT-POS-b3e365b9-1_1 |
|
EN300-107047_1_1_1 |
|
0.7 ± 0.3 |
|
|
||||
| RUN465 | MAT-POS-b3e365b9-1_1 |
|
RAL-THA-c9f97604-1_1 |
|
0.7 ± 0.2 |
|
|
||||
| RUN2459 | MAT-POS-b3e365b9-1_1 |
|
EDJ-MED-d203f206-36_1 |
|
0.7 ± 0.2 |
|
|
||||
| RUN639 | MAT-POS-b3e365b9-1_1 |
|
MAK-UNK-ffc90da7-6_1 |
|
0.7 ± 0.3 |
|
|
||||
| RUN1165 | MAT-POS-b3e365b9-1_1 |
|
RAL-THA-8416115c-13_1 |
|
0.7 ± 0.3 |
|
|
||||
| RUN7123 | MAT-POS-b3e365b9-1_1 |
|
EN300-6739162_1_1_1 |
|
0.7 ± 0.4 |
|
|
||||
| RUN7634 | MAT-POS-b3e365b9-1_1 |
|
EN300-233821_2_1_1 |
|
0.7 ± 0.3 |
|
|
||||
| RUN1835 | MAT-POS-b3e365b9-1_1 |
|
RAL-THA-2d450e86-32_1 |
|
0.7 ± 0.3 |
|
|
||||
| RUN5573 | MAT-POS-b3e365b9-1_1 |
|
EN300-748753_1_1_1 |
|
0.7 ± 0.3 |
|
|
||||
| RUN287 | MAT-POS-b3e365b9-1_1 |
|
DAR-DIA-6a508060-4_1 |
|
0.7 ± 0.3 |
|
|
||||
| RUN7222 | MAT-POS-b3e365b9-1_1 |
|
EN300-178288_2_4_1 |
|
0.7 ± 0.3 |
|
|
||||
| RUN140 | MAT-POS-b3e365b9-1_1 |
|
VLA-UCB-1dbca3b4-14_1 |
|
0.7 ± 0.1 |
|
|
||||
| RUN2573 | MAT-POS-b3e365b9-1_1 |
|
ALF-EVA-0b412456-4_2 |
|
0.7 ± 0.4 |
|
|
||||
| RUN415 | MAT-POS-b3e365b9-1_1 |
|
MAK-UNK-8be7dca9-3_3 |
|
0.7 ± 0.4 |
|
|
||||
| RUN2692 | MAT-POS-b3e365b9-1_1 |
|
EN300-6744029_2_1_1 |
|
0.7 ± 0.4 |
|
|
||||
| RUN5553 | MAT-POS-b3e365b9-1_1 |
|
EN300-304662_2_1_1 |
|
0.7 ± 0.3 |
|
|
||||
| RUN4972 | MAT-POS-b3e365b9-1_1 |
|
EN300-7470991_1_1_1 |
|
0.7 ± 0.3 |
|
|
||||
| RUN7386 | MAT-POS-b3e365b9-1_1 |
|
EN300-315854_4_1_1 |
|
0.7 ± 0.3 |
|
|
||||
| RUN2116 | MAT-POS-b3e365b9-1_1 |
|
LEE-CAM-7ab9b158-2_1 |
|
0.7 ± 0.3 |
|
|
||||
| RUN5847 | MAT-POS-b3e365b9-1_1 |
|
EN300-862094_2_2_1 |
|
0.7 ± 0.3 |
|
|
||||
| RUN549 | MAT-POS-b3e365b9-1_1 |
|
MIC-UNK-bcd487e9-8_1 |
|
0.7 ± 0.4 |
|
|
||||
| RUN6100 | MAT-POS-b3e365b9-1_1 |
|
EN300-6766760_4_1_1 |
|
0.7 ± 0.4 |
|
|
||||
| RUN5630 | MAT-POS-b3e365b9-1_1 |
|
EN300-1266218_2_1_1 |
|
0.7 ± 0.4 |
|
|
||||
| RUN4532 | MAT-POS-b3e365b9-1_1 |
|
EN300-51411_1_1_1 |
|
0.7 ± 0.3 |
|
|
||||
| RUN7537 | MAT-POS-b3e365b9-1_1 |
|
EN300-393148_4_1_1 |
|
0.7 ± 0.4 |
|
|
||||
| RUN6770 | MAT-POS-b3e365b9-1_1 |
|
EN300-304695_3_1_1 |
|
0.7 ± 0.3 |
|
|
||||
| RUN5674 | MAT-POS-b3e365b9-1_1 |
|
EN300-51801_1_1_1 |
|
0.7 ± 0.2 |
|
|
||||
| RUN6289 | MAT-POS-b3e365b9-1_1 |
|
EN300-325729_2_1_1 |
|
0.7 ± 0.3 |
|
|
||||
| RUN2238 | MAT-POS-b3e365b9-1_1 |
|
KAD-UNI-80f122c8-4_2 |
|
0.7 ± 0.3 |
|
|
||||
| RUN2229 | MAT-POS-b3e365b9-1_1 |
|
MAT-POS-f9802937-6_1 |
|
0.7 ± 0.2 |
|
|
||||
| RUN6665 | MAT-POS-b3e365b9-1_1 |
|
EN300-48902_2_2_1 |
|
0.7 ± 0.4 |
|
|
||||
| RUN5642 | MAT-POS-b3e365b9-1_1 |
|
EN300-146491_3_1_1 |
|
0.7 ± 0.3 |
|
|
||||
| RUN6995 | MAT-POS-b3e365b9-1_1 |
|
EN300-316258_2_1_1 |
|
0.7 ± 0.2 |
|
|
||||
| RUN2157 | MAT-POS-b3e365b9-1_1 |
|
MAT-POS-e9e99895-6_1 |
|
0.7 ± 0.5 |
|
|
||||
| RUN6678 | MAT-POS-b3e365b9-1_1 |
|
EN300-1091496_2_2_1 |
|
0.7 ± 0.3 |
|
|
||||
| RUN7466 | MAT-POS-b3e365b9-1_1 |
|
EN300-41863_2_1_1 |
|
0.7 ± 0.2 |
|
|
||||
| RUN5638 | MAT-POS-b3e365b9-1_1 |
|
EN300-179352_1_1_1 |
|
0.7 ± 0.3 |
|
|
||||
| RUN577 | MAT-POS-b3e365b9-1_1 |
|
MAK-UNK-ffc90da7-2_4 |
|
0.7 ± 0.3 |
|
|
||||
| RUN605 | MAT-POS-b3e365b9-1_1 |
|
MIC-UNK-5a93dd5f-1_4 |
|
0.7 ± 0.4 |
|
|
||||
| RUN1157 | MAT-POS-b3e365b9-1_1 |
|
RAL-THA-8416115c-9_4 |
|
0.7 ± 0.4 |
|
|
||||
| RUN2373 | MAT-POS-b3e365b9-1_1 |
|
ALP-UNI-3496895b-15_6 |
|
0.7 ± 0.3 |
|
|
||||
| RUN4423 | MAT-POS-b3e365b9-1_1 |
|
EN300-75342_3_1_1 |
|
0.7 ± 0.3 |
|
|
||||
| RUN7530 | MAT-POS-b3e365b9-1_1 |
|
EN300-120920_4_1_1 |
|
0.7 ± 0.3 |
|
|
||||
| RUN1299 | MAT-POS-b3e365b9-1_1 |
|
EDG-MED-971238d3-7_1 |
|
0.7 ± 0.2 |
|
|
||||
| RUN7739 | MAT-POS-b3e365b9-1_1 |
|
EN300-68225_2_1_1 |
|
0.7 ± 0.2 |
|
|
||||
| RUN1234 | MAT-POS-b3e365b9-1_1 |
|
LON-WEI-5e7d1b3e-53_1 |
|
0.7 ± 0.6 |
|
|
||||
| RUN7153 | MAT-POS-b3e365b9-1_1 |
|
EN300-741926_2_4_1 |
|
0.7 ± 0.4 |
|
|
||||
| RUN6163 | MAT-POS-b3e365b9-1_1 |
|
EN300-325738_1_1_1 |
|
0.8 ± 0.3 |
|
|
||||
| RUN232 | MAT-POS-b3e365b9-1_1 |
|
EDJ-MED-e4b030d8-1_1 |
|
0.8 ± 0.1 |
|
|
||||
| RUN3092 | MAT-POS-b3e365b9-1_1 |
|
EN300-125874_1_1_1 |
|
0.8 ± 0.3 |
|
|
||||
| RUN6043 | MAT-POS-b3e365b9-1_1 |
|
EN300-2008240_2_1_1 |
|
0.8 ± 0.4 |
|
|
||||
| RUN7154 | MAT-POS-b3e365b9-1_1 |
|
EN300-217107_4_4_1 |
|
0.8 ± 0.4 |
|
|
||||
| RUN6885 | MAT-POS-b3e365b9-1_1 |
|
EN300-6526690_2_1_1 |
|
0.8 ± 0.3 |
|
|
||||
| RUN1773 | MAT-POS-b3e365b9-1_1 |
|
PET-UNK-b87f07d0-3_1 |
|
0.8 ± 0.4 |
|
|
||||
| RUN1606 | MAT-POS-b3e365b9-1_1 |
|
EDG-MED-90036822-42_1 |
|
0.8 ± 0.3 |
|
|
||||
| RUN626 | MAT-POS-b3e365b9-1_1 |
|
MIC-UNK-5a93dd5f-2_5 |
|
0.8 ± 0.4 |
|
|
||||
| RUN476 | MAT-POS-b3e365b9-1_1 |
|
MIC-UNK-cdc2493e-3_1 |
|
0.8 ± 0.4 |
|
|
||||
| RUN2671 | MAT-POS-b3e365b9-1_1 |
|
EDJ-MED-ee07cf00-6_3 |
|
0.8 ± 0.5 |
|
|
||||
| RUN6631 | MAT-POS-b3e365b9-1_1 |
|
EN300-184355_2_2_1 |
|
0.8 ± 0.3 |
|
|
||||
| RUN6486 | MAT-POS-b3e365b9-1_1 |
|
EN300-7355737_4_1_2 |
|
0.8 ± 0.3 |
|
|
||||
| RUN7009 | MAT-POS-b3e365b9-1_1 |
|
EN300-649738_1_1_1 |
|
0.8 ± 0.2 |
|
|
||||
| RUN6769 | MAT-POS-b3e365b9-1_1 |
|
EN300-70092_1_1_1 |
|
0.8 ± 0.4 |
|
|
||||
| RUN6527 | MAT-POS-b3e365b9-1_1 |
|
EN300-25572_2_2_1 |
|
0.8 ± 0.3 |
|
|
||||
| RUN7131 | MAT-POS-b3e365b9-1_1 |
|
EN300-62857_1_1_1 |
|
0.8 ± 0.4 |
|
|
||||
| RUN2417 | MAT-POS-b3e365b9-1_1 |
|
EDJ-MED-d203f206-12_1 |
|
0.8 ± 0.2 |
|
|
||||
| RUN772 | MAT-POS-b3e365b9-1_1 |
|
DAR-DIA-0d514e7d-17_1 |
|
0.8 ± 0.2 |
|
|
||||
| RUN1842 | MAT-POS-b3e365b9-1_1 |
|
RAL-THA-2d450e86-30_1 |
|
0.8 ± 0.2 |
|
|
||||
| RUN7622 | MAT-POS-b3e365b9-1_1 |
|
EN300-378316_4_1_1 |
|
0.8 ± 0.6 |
|
|
||||