| RUN | Initial microstate | Final microstate | ΔΔG / kcal M-1 | Work distribution | Convergence | ||||||
|---|---|---|---|---|---|---|---|---|---|---|---|
| RUN6609 | MAT-POS-b3e365b9-1_1 |
|
EN300-254883_4_1_1 |
|
0.2 ± 0.3 |
|
|
||||
| RUN5282 | MAT-POS-b3e365b9-1_1 |
|
EN300-2977549_4_1_1 |
|
0.2 ± 0.3 |
|
|
||||
| RUN7533 | MAT-POS-b3e365b9-1_1 |
|
EN300-306774_1_2_1 |
|
0.2 ± 0.2 |
|
|
||||
| RUN7525 | MAT-POS-b3e365b9-1_1 |
|
EN300-67023_3_1_1 |
|
0.2 ± 0.4 |
|
|
||||
| RUN1993 | MAT-POS-b3e365b9-1_1 |
|
MAT-POS-c74bc7b3-1_1 |
|
0.2 ± 0.3 |
|
|
||||
| RUN5555 | MAT-POS-b3e365b9-1_1 |
|
EN300-304135_2_2_1 |
|
0.2 ± 0.4 |
|
|
||||
| RUN6627 | MAT-POS-b3e365b9-1_1 |
|
EN300-226314_2_1_1 |
|
0.2 ± 0.3 |
|
|
||||
| RUN734 | MAT-POS-b3e365b9-1_1 |
|
DAR-DIA-0d514e7d-3_1 |
|
0.2 ± 0.2 |
|
|
||||
| RUN576 | MAT-POS-b3e365b9-1_1 |
|
ADA-UCB-dc2b944c-2_1 |
|
0.2 ± 0.5 |
|
|
||||
| RUN2300 | MAT-POS-b3e365b9-1_1 |
|
ALP-POS-5bb456a5-1_10 |
|
0.2 ± 0.5 |
|
|
||||
| RUN1496 | MAT-POS-b3e365b9-1_1 |
|
ED_-GRI-5b13fbe2-36_2 |
|
0.2 ± 0.3 |
|
|
||||
| RUN7414 | MAT-POS-b3e365b9-1_1 |
|
EN300-139130_1_1_1 |
|
0.2 ± 0.4 |
|
|
||||
| RUN1308 | MAT-POS-b3e365b9-1_1 |
|
JOH-UNI-a38a7bdd-5_1 |
|
0.2 ± 0.3 |
|
|
||||
| RUN495 | MAT-POS-b3e365b9-1_1 |
|
MIC-UNK-cdc2493e-12_2 |
|
0.2 ± 0.4 |
|
|
||||
| RUN6990 | MAT-POS-b3e365b9-1_1 |
|
EN300-221122_1_1_1 |
|
0.2 ± 0.4 |
|
|
||||
| RUN666 | MAT-POS-b3e365b9-1_1 |
|
MIC-UNK-5a93dd5f-9_1 |
|
0.2 ± 0.4 |
|
|
||||
| RUN10 | MAT-POS-b3e365b9-1_1 |
|
DAR-DIA-0cde14eb-48_1 |
|
0.2 ± 0.3 |
|
|
||||
| RUN2130 | MAT-POS-b3e365b9-1_1 |
|
MAT-POS-e9e99895-2_6 |
|
0.2 ± 0.8 |
|
|
||||
| RUN2248 | MAT-POS-b3e365b9-1_1 |
|
ALP-POS-5bb456a5-7_1 |
|
0.2 ± 0.3 |
|
|
||||
| RUN6661 | MAT-POS-b3e365b9-1_1 |
|
EN300-118647_1_1_1 |
|
0.2 ± 0.2 |
|
|
||||
| RUN5108 | MAT-POS-b3e365b9-1_1 |
|
EN300-7499295_2_1_1 |
|
0.2 ± 0.3 |
|
|
||||
| RUN7220 | MAT-POS-b3e365b9-1_1 |
|
EN300-141645_1_1_1 |
|
0.2 ± 0.3 |
|
|
||||
| RUN5986 | MAT-POS-b3e365b9-1_1 |
|
EN300-6744028_2_6_1 |
|
0.2 ± 0.3 |
|
|
||||
| RUN6594 | MAT-POS-b3e365b9-1_1 |
|
EN300-138676_2_1_1 |
|
0.2 ± 0.2 |
|
|
||||
| RUN1609 | MAT-POS-b3e365b9-1_1 |
|
EDG-MED-90036822-70_1 |
|
0.2 ± 0.4 |
|
|
||||
| RUN760 | MAT-POS-b3e365b9-1_1 |
|
DAR-DIA-0d514e7d-32_7 |
|
0.2 ± 0.4 |
|
|
||||
| RUN5826 | MAT-POS-b3e365b9-1_1 |
|
EN300-50639_1_2_1 |
|
0.2 ± 0.4 |
|
|
||||
| RUN5335 | MAT-POS-b3e365b9-1_1 |
|
EN300-222969_2_1_1 |
|
0.2 ± 0.3 |
|
|
||||
| RUN6987 | MAT-POS-b3e365b9-1_1 |
|
EN300-82539_1_2_1 |
|
0.2 ± 0.4 |
|
|
||||
| RUN6825 | MAT-POS-b3e365b9-1_1 |
|
EN300-6494158_2_4_1 |
|
0.2 ± 0.3 |
|
|
||||
| RUN6793 | MAT-POS-b3e365b9-1_1 |
|
EN300-39458_2_1_1 |
|
0.2 ± 0.3 |
|
|
||||
| RUN2322 | MAT-POS-b3e365b9-1_1 |
|
ALP-UNI-0676e700-11_1 |
|
0.2 ± 0.3 |
|
|
||||
| RUN1058 | MAT-POS-b3e365b9-1_1 |
|
BEN-DND-f2e727cd-3_1 |
|
0.2 ± 0.4 |
|
|
||||
| RUN803 | MAT-POS-b3e365b9-1_1 |
|
DAR-DIA-0d514e7d-20_1 |
|
0.2 ± 0.2 |
|
|
||||
| RUN1430 | MAT-POS-b3e365b9-1_1 |
|
ED_-GRI-5b13fbe2-50_4 |
|
0.2 ± 0.3 |
|
|
||||
| RUN3531 | MAT-POS-b3e365b9-1_1 |
|
EN300-343562_2_1_1 |
|
0.2 ± 0.4 |
|
|
||||
| RUN7327 | MAT-POS-b3e365b9-1_1 |
|
EN300-211482_1_2_1 |
|
0.2 ± 0.2 |
|
|
||||
| RUN838 | MAT-POS-b3e365b9-1_1 |
|
MAK-UNK-c749d764-4_2 |
|
0.2 ± 0.3 |
|
|
||||
| RUN7462 | MAT-POS-b3e365b9-1_1 |
|
EN300-7501753_2_1_1 |
|
0.2 ± 0.3 |
|
|
||||
| RUN4475 | MAT-POS-b3e365b9-1_1 |
|
EN300-191904_4_1_1 |
|
0.2 ± 0.4 |
|
|
||||
| RUN5816 | MAT-POS-b3e365b9-1_1 |
|
EN300-77343_2_1_1 |
|
0.2 ± 0.3 |
|
|
||||
| RUN1548 | MAT-POS-b3e365b9-1_1 |
|
EDG-MED-90036822-14_2 |
|
0.2 ± 0.4 |
|
|
||||
| RUN1388 | MAT-POS-b3e365b9-1_1 |
|
DAR-DIA-9e4459de-13_1 |
|
0.2 ± 0.3 |
|
|
||||
| RUN2341 | MAT-POS-b3e365b9-1_1 |
|
ALP-UNI-3496895b-15_1 |
|
0.2 ± 0.3 |
|
|
||||
| RUN6055 | MAT-POS-b3e365b9-1_1 |
|
EN300-6472952_1_1_1 |
|
0.2 ± 0.4 |
|
|
||||
| RUN3926 | MAT-POS-b3e365b9-1_1 |
|
EN300-204936_2_1_1 |
|
0.2 ± 0.3 |
|
|
||||
| RUN5688 | MAT-POS-b3e365b9-1_1 |
|
EN300-1253122_2_1_1 |
|
0.2 ± 0.3 |
|
|
||||
| RUN6822 | MAT-POS-b3e365b9-1_1 |
|
EN300-75819_1_1_1 |
|
0.2 ± 0.4 |
|
|
||||
| RUN5689 | MAT-POS-b3e365b9-1_1 |
|
EN300-1726150_2_1_1 |
|
0.2 ± 0.4 |
|
|
||||
| RUN1789 | MAT-POS-b3e365b9-1_1 |
|
RAL-THA-2d450e86-15_1 |
|
0.2 ± 0.3 |
|
|
||||
| RUN5505 | MAT-POS-b3e365b9-1_1 |
|
EN300-384241_1_1_1 |
|
0.2 ± 0.5 |
|
|
||||
| RUN469 | MAT-POS-b3e365b9-1_1 |
|
MIC-UNK-cdc2493e-1_1 |
|
0.2 ± 0.3 |
|
|
||||
| RUN6664 | MAT-POS-b3e365b9-1_1 |
|
EN300-7471076_1_1_1 |
|
0.2 ± 0.3 |
|
|
||||
| RUN1475 | MAT-POS-b3e365b9-1_1 |
|
ED_-GRI-5b13fbe2-51_1 |
|
0.2 ± 0.3 |
|
|
||||
| RUN6597 | MAT-POS-b3e365b9-1_1 |
|
EN300-238405_1_2_1 |
|
0.2 ± 0.2 |
|
|
||||
| RUN1772 | MAT-POS-b3e365b9-1_1 |
|
ALP-POS-869ac754-1_1 |
|
0.23 ± 0.08 |
|
|
||||
| RUN1683 | MAT-POS-b3e365b9-1_1 |
|
EDJ-MED-a6bd50ad-1_1 |
|
0.2 ± 0.3 |
|
|
||||
| RUN7424 | MAT-POS-b3e365b9-1_1 |
|
EN300-1721331_1_1_1 |
|
0.2 ± 0.4 |
|
|
||||
| RUN6828 | MAT-POS-b3e365b9-1_1 |
|
EN300-343103_3_1_1 |
|
0.2 ± 0.3 |
|
|
||||
| RUN1646 | MAT-POS-b3e365b9-1_1 |
|
EDG-MED-90036822-89_1 |
|
0.2 ± 0.3 |
|
|
||||
| RUN4945 | MAT-POS-b3e365b9-1_1 |
|
EN300-92684_1_1_1 |
|
0.2 ± 0.4 |
|
|
||||
| RUN6913 | MAT-POS-b3e365b9-1_1 |
|
EN300-62166_2_1_1 |
|
0.2 ± 0.3 |
|
|
||||
| RUN1440 | MAT-POS-b3e365b9-1_1 |
|
ED_-GRI-5b13fbe2-28_1 |
|
0.2 ± 0.3 |
|
|
||||
| RUN3162 | MAT-POS-b3e365b9-1_1 |
|
EN300-18928_3_1_1 |
|
0.2 ± 0.5 |
|
|
||||
| RUN7737 | MAT-POS-b3e365b9-1_1 |
|
EN300-6482296_2_1_1 |
|
0.2 ± 0.3 |
|
|
||||
| RUN6313 | MAT-POS-b3e365b9-1_1 |
|
EN300-12204_3_1_1 |
|
0.2 ± 0.4 |
|
|
||||
| RUN542 | MAT-POS-b3e365b9-1_1 |
|
MIC-UNK-bcd487e9-5_1 |
|
0.2 ± 0.3 |
|
|
||||
| RUN7045 | MAT-POS-b3e365b9-1_1 |
|
EN300-633533_4_1_1 |
|
0.2 ± 0.4 |
|
|
||||
| RUN4881 | MAT-POS-b3e365b9-1_1 |
|
EN300-210084_1_2_1 |
|
0.2 ± 0.3 |
|
|
||||
| RUN400 | MAT-POS-b3e365b9-1_1 |
|
DAR-DIA-23e5a6a0-9_2 |
|
0.2 ± 0.2 |
|
|
||||
| RUN7694 | MAT-POS-b3e365b9-1_1 |
|
EN300-82539_1_1_1 |
|
0.2 ± 0.3 |
|
|
||||
| RUN6747 | MAT-POS-b3e365b9-1_1 |
|
EN300-117059_2_1_1 |
|
0.2 ± 0.2 |
|
|
||||
| RUN4608 | MAT-POS-b3e365b9-1_1 |
|
EN300-48886_1_1_1 |
|
0.2 ± 0.3 |
|
|
||||
| RUN4242 | MAT-POS-b3e365b9-1_1 |
|
EN300-17381_2_1_1 |
|
0.2 ± 0.2 |
|
|
||||
| RUN5075 | MAT-POS-b3e365b9-1_1 |
|
EN300-344753_1_1_1 |
|
0.2 ± 0.4 |
|
|
||||
| RUN7305 | MAT-POS-b3e365b9-1_1 |
|
EN300-1988306_2_1_1 |
|
0.2 ± 0.5 |
|
|
||||
| RUN5051 | MAT-POS-b3e365b9-1_1 |
|
EN300-25446_4_1_1 |
|
0.2 ± 0.3 |
|
|
||||
| RUN6819 | MAT-POS-b3e365b9-1_1 |
|
EN300-65414_1_1_1 |
|
0.2 ± 0.3 |
|
|
||||
| RUN349 | MAT-POS-b3e365b9-1_1 |
|
DAR-DIA-23e5a6a0-6_1 |
|
0.2 ± 0.4 |
|
|
||||
| RUN127 | MAT-POS-b3e365b9-1_1 |
|
MAT-POS-9ff17035-1_1 |
|
0.2 ± 0.4 |
|
|
||||
| RUN6869 | MAT-POS-b3e365b9-1_1 |
|
EN300-36851_1_4_1 |
|
0.3 ± 0.3 |
|
|
||||
| RUN2180 | MAT-POS-b3e365b9-1_1 |
|
ALF-EVA-5b152d2f-6_1 |
|
0.3 ± 0.2 |
|
|
||||
| RUN1291 | MAT-POS-b3e365b9-1_1 |
|
BEN-DND-a7517465-1_1 |
|
0.25 ± 0.06 |
|
|
||||
| RUN1068 | MAT-POS-b3e365b9-1_1 |
|
BEN-DND-f2e727cd-5_1 |
|
0.3 ± 0.3 |
|
|
||||
| RUN6588 | MAT-POS-b3e365b9-1_1 |
|
DAR-DIA-0d514e7d-15_1_1 |
|
0.3 ± 0.2 |
|
|
||||
| RUN1003 | MAT-POS-b3e365b9-1_1 |
|
JOH-SUS-a69c159d-1_1 |
|
0.25 ± 0.07 |
|
|
||||
| RUN1067 | MAT-POS-b3e365b9-1_1 |
|
BEN-DND-f2e727cd-2_1 |
|
0.3 ± 0.3 |
|
|
||||
| RUN7152 | MAT-POS-b3e365b9-1_1 |
|
EN300-314838_1_1_1 |
|
0.3 ± 0.3 |
|
|
||||
| RUN4584 | MAT-POS-b3e365b9-1_1 |
|
EN300-40153_1_1_1 |
|
0.3 ± 0.2 |
|
|
||||
| RUN6881 | MAT-POS-b3e365b9-1_1 |
|
EN300-97300_3_1_1 |
|
0.3 ± 0.2 |
|
|
||||
| RUN5978 | MAT-POS-b3e365b9-1_1 |
|
EN300-83434_1_2_1 |
|
0.3 ± 0.3 |
|
|
||||
| RUN5355 | MAT-POS-b3e365b9-1_1 |
|
EN300-92031_2_1_1 |
|
0.3 ± 0.4 |
|
|
||||
| RUN7690 | MAT-POS-b3e365b9-1_1 |
|
EN300-1692359_1_2_1 |
|
0.3 ± 0.3 |
|
|
||||
| RUN5009 | MAT-POS-b3e365b9-1_1 |
|
EN300-121078_2_1_1 |
|
0.3 ± 0.3 |
|
|
||||
| RUN6357 | MAT-POS-b3e365b9-1_1 |
|
EN300-187385_1_1_1 |
|
0.3 ± 0.3 |
|
|
||||
| RUN7361 | MAT-POS-b3e365b9-1_1 |
|
EN300-1215712_1_1_1 |
|
0.3 ± 0.3 |
|
|
||||
| RUN7630 | MAT-POS-b3e365b9-1_1 |
|
EN300-183231_1_1_1 |
|
0.3 ± 0.3 |
|
|
||||
| RUN7210 | MAT-POS-b3e365b9-1_1 |
|
EN300-1700710_4_1_1 |
|
0.3 ± 0.4 |
|
|
||||
| RUN5774 | MAT-POS-b3e365b9-1_1 |
|
EN300-99161_1_2_1 |
|
0.3 ± 0.3 |
|
|
||||
| RUN5812 | MAT-POS-b3e365b9-1_1 |
|
EN300-155498_2_1_2 |
|
0.3 ± 0.3 |
|
|
||||