| RUN | Initial microstate | Final microstate | ΔΔG / kcal M-1 | Work distribution | Convergence | ||||||
|---|---|---|---|---|---|---|---|---|---|---|---|
| RUN3864 | MAT-POS-b3e365b9-1_1 |
|
EN300-244947_1_1_1 |
|
−1.7 ± 0.2 |
|
|
||||
| RUN254 | MAT-POS-b3e365b9-1_1 |
|
EDJ-MED-e4b030d8-6_1 |
|
−1.68 ± 0.10 |
|
|
||||
| RUN6094 | MAT-POS-b3e365b9-1_1 |
|
EN300-68794_3_1_1 |
|
−1.7 ± 0.3 |
|
|
||||
| RUN6976 | MAT-POS-b3e365b9-1_1 |
|
EN300-02067_3_2_1 |
|
−1.7 ± 0.3 |
|
|
||||
| RUN1273 | MAT-POS-b3e365b9-1_1 |
|
DAR-DIA-076fb6ea-9_1 |
|
−1.7 ± 0.3 |
|
|
||||
| RUN4535 | MAT-POS-b3e365b9-1_1 |
|
EN300-180875_1_1_1 |
|
−1.7 ± 0.3 |
|
|
||||
| RUN1470 | MAT-POS-b3e365b9-1_1 |
|
ED_-GRI-5b13fbe2-64_1 |
|
−1.7 ± 0.3 |
|
|
||||
| RUN1428 | MAT-POS-b3e365b9-1_1 |
|
ED_-GRI-5b13fbe2-57_1 |
|
−1.7 ± 0.2 |
|
|
||||
| RUN3415 | MAT-POS-b3e365b9-1_1 |
|
EN300-7447185_1_1_1 |
|
−1.7 ± 0.3 |
|
|
||||
| RUN4969 | MAT-POS-b3e365b9-1_1 |
|
EN300-1301381_3_2_1 |
|
−1.7 ± 0.3 |
|
|
||||
| RUN3484 | MAT-POS-b3e365b9-1_1 |
|
EN300-156318_1_1_1 |
|
−1.7 ± 0.3 |
|
|
||||
| RUN6060 | MAT-POS-b3e365b9-1_1 |
|
EN300-204935_1_1_1 |
|
−1.7 ± 0.3 |
|
|
||||
| RUN1480 | MAT-POS-b3e365b9-1_1 |
|
ED_-GRI-5b13fbe2-67_2 |
|
−1.7 ± 0.3 |
|
|
||||
| RUN4322 | MAT-POS-b3e365b9-1_1 |
|
EN300-131572_1_1_1 |
|
−1.7 ± 0.2 |
|
|
||||
| RUN5625 | MAT-POS-b3e365b9-1_1 |
|
MAK-UNK-8be7dca9-4_1_1 |
|
−1.67 ± 0.09 |
|
|
||||
| RUN1318 | MAT-POS-b3e365b9-1_1 |
|
DAR-DIA-9e4459de-15_6 |
|
−1.7 ± 0.3 |
|
|
||||
| RUN5461 | MAT-POS-b3e365b9-1_1 |
|
EN300-10397_3_1_1 |
|
−1.7 ± 0.3 |
|
|
||||
| RUN5038 | MAT-POS-b3e365b9-1_1 |
|
EN300-7461217_3_2_1 |
|
−1.7 ± 0.3 |
|
|
||||
| RUN3651 | MAT-POS-b3e365b9-1_1 |
|
EN300-7459545_3_2_1 |
|
−1.7 ± 0.5 |
|
|
||||
| RUN1685 | MAT-POS-b3e365b9-1_1 |
|
EDG-MED-90036822-94_11 |
|
−1.7 ± 0.3 |
|
|
||||
| RUN4588 | MAT-POS-b3e365b9-1_1 |
|
EN300-6486855_1_1_1 |
|
−1.7 ± 0.3 |
|
|
||||
| RUN3038 | MAT-POS-b3e365b9-1_1 |
|
EN300-263456_1_1_1 |
|
−1.7 ± 0.2 |
|
|
||||
| RUN5123 | MAT-POS-b3e365b9-1_1 |
|
EN300-6729747_1_2_1 |
|
−1.7 ± 0.4 |
|
|
||||
| RUN5927 | MAT-POS-b3e365b9-1_1 |
|
EN300-248521_1_1_1 |
|
−1.7 ± 0.4 |
|
|
||||
| RUN6864 | MAT-POS-b3e365b9-1_1 |
|
EN300-87536_1_1_1 |
|
−1.7 ± 0.3 |
|
|
||||
| RUN3526 | MAT-POS-b3e365b9-1_1 |
|
EN300-6494158_1_2_1 |
|
−1.7 ± 0.3 |
|
|
||||
| RUN3546 | MAT-POS-b3e365b9-1_1 |
|
EN300-149013_1_1_1 |
|
−1.7 ± 0.2 |
|
|
||||
| RUN1623 | MAT-POS-b3e365b9-1_1 |
|
EDG-MED-90036822-80_1 |
|
−1.7 ± 0.2 |
|
|
||||
| RUN1681 | MAT-POS-b3e365b9-1_1 |
|
EDG-MED-90036822-88_1 |
|
−1.7 ± 0.3 |
|
|
||||
| RUN4620 | MAT-POS-b3e365b9-1_1 |
|
EN300-155362_1_3_1 |
|
−1.6 ± 0.2 |
|
|
||||
| RUN4894 | MAT-POS-b3e365b9-1_1 |
|
EN300-60033_3_1_1 |
|
−1.6 ± 0.3 |
|
|
||||
| RUN5956 | MAT-POS-b3e365b9-1_1 |
|
EN300-2011576_1_1_1 |
|
−1.6 ± 0.2 |
|
|
||||
| RUN4784 | MAT-POS-b3e365b9-1_1 |
|
EN300-7355519_1_8_1 |
|
−1.6 ± 0.2 |
|
|
||||
| RUN5122 | MAT-POS-b3e365b9-1_1 |
|
EN300-211203_1_2_1 |
|
−1.6 ± 0.2 |
|
|
||||
| RUN5618 | MAT-POS-b3e365b9-1_1 |
|
EN300-182725_3_2_1 |
|
−1.6 ± 0.4 |
|
|
||||
| RUN1535 | MAT-POS-b3e365b9-1_1 |
|
EDG-MED-90036822-31_1 |
|
−1.6 ± 0.2 |
|
|
||||
| RUN5885 | MAT-POS-b3e365b9-1_1 |
|
EN300-18928_1_1_1 |
|
−1.6 ± 0.3 |
|
|
||||
| RUN6528 | MAT-POS-b3e365b9-1_1 |
|
EN300-133915_1_1_1 |
|
−1.6 ± 0.2 |
|
|
||||
| RUN4690 | MAT-POS-b3e365b9-1_1 |
|
EN300-64297_1_1_1 |
|
−1.6 ± 0.2 |
|
|
||||
| RUN4875 | MAT-POS-b3e365b9-1_1 |
|
EN300-219020_1_1_1 |
|
−1.6 ± 0.2 |
|
|
||||
| RUN4339 | MAT-POS-b3e365b9-1_1 |
|
EN300-263669_1_1_1 |
|
−1.6 ± 0.2 |
|
|
||||
| RUN4487 | MAT-POS-b3e365b9-1_1 |
|
EN300-116313_3_1_1 |
|
−1.6 ± 0.3 |
|
|
||||
| RUN5109 | MAT-POS-b3e365b9-1_1 |
|
EN300-178876_3_1_1 |
|
−1.6 ± 0.4 |
|
|
||||
| RUN4247 | MAT-POS-b3e365b9-1_1 |
|
EN300-189672_3_1_1 |
|
−1.6 ± 0.3 |
|
|
||||
| RUN1754 | MAT-POS-b3e365b9-1_1 |
|
EDG-MED-90036822-108_4 |
|
−1.6 ± 0.3 |
|
|
||||
| RUN3478 | MAT-POS-b3e365b9-1_1 |
|
EN300-223187_1_1_1 |
|
−1.6 ± 0.3 |
|
|
||||
| RUN1692 | MAT-POS-b3e365b9-1_1 |
|
EDG-MED-90036822-99_3 |
|
−1.6 ± 0.3 |
|
|
||||
| RUN4821 | MAT-POS-b3e365b9-1_1 |
|
EN300-113234_3_2_1 |
|
−1.6 ± 0.3 |
|
|
||||
| RUN2029 | MAT-POS-b3e365b9-1_1 |
|
KAD-UNI-8a629cb0-1_1 |
|
−1.6 ± 0.4 |
|
|
||||
| RUN4451 | MAT-POS-b3e365b9-1_1 |
|
EN300-12440_3_2_1 |
|
−1.6 ± 0.4 |
|
|
||||
| RUN3465 | MAT-POS-b3e365b9-1_1 |
|
EN300-120282_3_1_1 |
|
−1.6 ± 0.2 |
|
|
||||
| RUN3965 | MAT-POS-b3e365b9-1_1 |
|
EDJ-MED-e4b030d8-4_1_1 |
|
−1.6 ± 0.2 |
|
|
||||