| RUN | Initial microstate | Final microstate | ΔΔG / kcal M-1 | Work distribution | Convergence | ||||||
|---|---|---|---|---|---|---|---|---|---|---|---|
| RUN4074 | MAT-POS-b3e365b9-1_1 |
|
EN300-217494_3_1_1 |
|
−0.6 ± 0.2 |
|
|
||||
| RUN4789 | MAT-POS-b3e365b9-1_1 |
|
EN300-378316_3_1_1 |
|
−0.6 ± 0.4 |
|
|
||||
| RUN6037 | MAT-POS-b3e365b9-1_1 |
|
EN300-761618_1_1_1 |
|
−0.6 ± 0.2 |
|
|
||||
| RUN6840 | MAT-POS-b3e365b9-1_1 |
|
EN300-814032_2_1_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN3414 | MAT-POS-b3e365b9-1_1 |
|
EN300-1439991_1_1_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN2408 | MAT-POS-b3e365b9-1_1 |
|
EDJ-MED-d203f206-25_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN7562 | MAT-POS-b3e365b9-1_1 |
|
EN300-77778_4_1_1 |
|
−0.6 ± 0.4 |
|
|
||||
| RUN6879 | MAT-POS-b3e365b9-1_1 |
|
EN300-306144_1_1_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN7749 | MAT-POS-b3e365b9-1_1 |
|
EN300-6478526_2_1_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN598 | MAT-POS-b3e365b9-1_1 |
|
JAG-UCB-706446eb-1_1 |
|
−0.6 ± 0.2 |
|
|
||||
| RUN6175 | MAT-POS-b3e365b9-1_1 |
|
EN300-155589_1_1_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN7593 | MAT-POS-b3e365b9-1_1 |
|
EN300-51257_2_2_1 |
|
−0.6 ± 0.2 |
|
|
||||
| RUN1664 | MAT-POS-b3e365b9-1_1 |
|
EDG-MED-90036822-38_1 |
|
−0.6 ± 0.4 |
|
|
||||
| RUN5175 | MAT-POS-b3e365b9-1_1 |
|
EN300-261410_1_1_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN3571 | MAT-POS-b3e365b9-1_1 |
|
EN300-7432415_3_1_1 |
|
−0.6 ± 0.4 |
|
|
||||
| RUN1097 | MAT-POS-b3e365b9-1_1 |
|
BEN-DND-c852c98b-4_1 |
|
−0.59 ± 0.04 |
|
|
||||
| RUN5349 | MAT-POS-b3e365b9-1_1 |
|
EN300-186943_3_1_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN3681 | MAT-POS-b3e365b9-1_1 |
|
EN300-52193_1_1_1 |
|
−0.6 ± 0.2 |
|
|
||||
| RUN3854 | MAT-POS-b3e365b9-1_1 |
|
EN300-222145_1_1_1 |
|
−0.6 ± 0.2 |
|
|
||||
| RUN2592 | MAT-POS-b3e365b9-1_1 |
|
EDG-MED-ba1ac7b9-26_2 |
|
−0.6 ± 0.4 |
|
|
||||
| RUN5732 | MAT-POS-b3e365b9-1_1 |
|
EN300-45049_4_2_1 |
|
−0.6 ± 0.4 |
|
|
||||
| RUN5959 | MAT-POS-b3e365b9-1_1 |
|
EN300-378343_1_1_1 |
|
−0.6 ± 0.2 |
|
|
||||
| RUN2568 | MAT-POS-b3e365b9-1_1 |
|
ALF-EVA-0b412456-8_2 |
|
−0.6 ± 0.4 |
|
|
||||
| RUN1365 | MAT-POS-b3e365b9-1_1 |
|
ALP-POS-fab80cf2-1_2 |
|
−0.6 ± 0.5 |
|
|
||||
| RUN2893 | MAT-POS-b3e365b9-1_1 |
|
EN300-1072199_1_2_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN7687 | MAT-POS-b3e365b9-1_1 |
|
EN300-18074_1_1_1 |
|
−0.6 ± 0.1 |
|
|
||||
| RUN6705 | MAT-POS-b3e365b9-1_1 |
|
EN300-76584_1_1_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN1644 | MAT-POS-b3e365b9-1_1 |
|
EDG-MED-90036822-81_1 |
|
−0.6 ± 0.5 |
|
|
||||
| RUN6608 | MAT-POS-b3e365b9-1_1 |
|
EN300-6729572_2_5_1 |
|
−0.6 ± 0.2 |
|
|
||||
| RUN6580 | MAT-POS-b3e365b9-1_1 |
|
EN300-1709295_3_1_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN6242 | MAT-POS-b3e365b9-1_1 |
|
EN300-365993_1_1_1 |
|
−0.6 ± 0.4 |
|
|
||||
| RUN4986 | MAT-POS-b3e365b9-1_1 |
|
EN300-2011576_3_1_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN1458 | MAT-POS-b3e365b9-1_1 |
|
ED_-GRI-5b13fbe2-16_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN3979 | MAT-POS-b3e365b9-1_1 |
|
EN300-6498351_1_1_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN6583 | MAT-POS-b3e365b9-1_1 |
|
EN300-91905_1_1_1 |
|
−0.6 ± 0.2 |
|
|
||||
| RUN7725 | MAT-POS-b3e365b9-1_1 |
|
EN300-378828_1_1_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN3911 | MAT-POS-b3e365b9-1_1 |
|
EN300-173006_2_2_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN4990 | MAT-POS-b3e365b9-1_1 |
|
EN300-75342_1_1_1 |
|
−0.6 ± 0.2 |
|
|
||||
| RUN2185 | MAT-POS-b3e365b9-1_1 |
|
EDG-MED-0e5afe9d-3_2 |
|
−0.6 ± 0.1 |
|
|
||||
| RUN6843 | MAT-POS-b3e365b9-1_1 |
|
EN300-7430501_2_1_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN5435 | MAT-POS-b3e365b9-1_1 |
|
EN300-80241_1_2_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN7803 | MAT-POS-b3e365b9-1_1 |
|
EN300-7237143_1_1_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN6134 | MAT-POS-b3e365b9-1_1 |
|
EN300-5638430_1_1_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN4141 | MAT-POS-b3e365b9-1_1 |
|
EN300-171766_2_1_1 |
|
−0.6 ± 0.2 |
|
|
||||
| RUN564 | MAT-POS-b3e365b9-1_1 |
|
PET-UNK-29afea89-2_1 |
|
−0.6 ± 0.1 |
|
|
||||
| RUN4176 | MAT-POS-b3e365b9-1_1 |
|
EN300-6496666_1_1_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN4476 | MAT-POS-b3e365b9-1_1 |
|
EN300-6498351_3_1_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN5110 | MAT-POS-b3e365b9-1_1 |
|
EN300-20496_4_2_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN7522 | MAT-POS-b3e365b9-1_1 |
|
EN300-7434334_2_1_1 |
|
−0.6 ± 0.2 |
|
|
||||
| RUN5203 | MAT-POS-b3e365b9-1_1 |
|
EN300-183231_4_1_1 |
|
−0.6 ± 0.6 |
|
|
||||
| RUN6139 | MAT-POS-b3e365b9-1_1 |
|
EN300-199359_1_1_1 |
|
−0.6 ± 0.2 |
|
|
||||
| RUN5198 | MAT-POS-b3e365b9-1_1 |
|
EN300-301690_3_1_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN212 | MAT-POS-b3e365b9-1_1 |
|
MIC-UNK-9582b2c5-1_2 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN5623 | MAT-POS-b3e365b9-1_1 |
|
EN300-191771_1_1_1 |
|
−0.6 ± 0.4 |
|
|
||||
| RUN5223 | MAT-POS-b3e365b9-1_1 |
|
EN300-216673_4_1_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN5795 | MAT-POS-b3e365b9-1_1 |
|
EN300-154944_1_1_1 |
|
−0.6 ± 0.2 |
|
|
||||
| RUN292 | MAT-POS-b3e365b9-1_1 |
|
VLA-UCB-05e51b3f-9_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN6812 | MAT-POS-b3e365b9-1_1 |
|
EN300-31183_1_1_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN852 | MAT-POS-b3e365b9-1_1 |
|
MAK-UNK-83e0a0b4-1_1 |
|
−0.6 ± 0.7 |
|
|
||||
| RUN1171 | MAT-POS-b3e365b9-1_1 |
|
RAL-THA-8416115c-8_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN3977 | MAT-POS-b3e365b9-1_1 |
|
EN300-254137_1_1_1 |
|
−0.6 ± 0.2 |
|
|
||||
| RUN6018 | MAT-POS-b3e365b9-1_1 |
|
EN300-31099_1_1_1 |
|
−0.6 ± 0.2 |
|
|
||||
| RUN6253 | MAT-POS-b3e365b9-1_1 |
|
EN300-321558_1_1_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN2525 | MAT-POS-b3e365b9-1_1 |
|
EDG-MED-ba1ac7b9-19_3 |
|
−0.6 ± 0.4 |
|
|
||||
| RUN6586 | MAT-POS-b3e365b9-1_1 |
|
EN300-125884_1_1_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN2368 | MAT-POS-b3e365b9-1_1 |
|
ALP-UNI-3496895b-4_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN7609 | MAT-POS-b3e365b9-1_1 |
|
EN300-269419_2_1_1 |
|
−0.6 ± 0.2 |
|
|
||||
| RUN7731 | MAT-POS-b3e365b9-1_1 |
|
EN300-43047_3_1_1 |
|
−0.6 ± 0.4 |
|
|
||||
| RUN4862 | MAT-POS-b3e365b9-1_1 |
|
VLA-UCB-34f3ed0c-10_1_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN3697 | MAT-POS-b3e365b9-1_1 |
|
EN300-248178_1_1_1 |
|
−0.6 ± 0.2 |
|
|
||||
| RUN5546 | MAT-POS-b3e365b9-1_1 |
|
EN300-211482_2_2_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN771 | MAT-POS-b3e365b9-1_1 |
|
DAR-DIA-0d514e7d-24_1 |
|
−0.6 ± 0.2 |
|
|
||||
| RUN5180 | MAT-POS-b3e365b9-1_1 |
|
EN300-7439980_1_1_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN1687 | MAT-POS-b3e365b9-1_1 |
|
EDG-MED-90036822-87_1 |
|
−0.6 ± 0.2 |
|
|
||||
| RUN5666 | MAT-POS-b3e365b9-1_1 |
|
EN300-861925_4_1_1 |
|
−0.6 ± 0.4 |
|
|
||||
| RUN4946 | MAT-POS-b3e365b9-1_1 |
|
EN300-7493255_1_1_1 |
|
−0.6 ± 0.4 |
|
|
||||
| RUN6694 | MAT-POS-b3e365b9-1_1 |
|
EN300-04073_1_1_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN5353 | MAT-POS-b3e365b9-1_1 |
|
EN300-114133_3_1_1 |
|
−0.6 ± 0.4 |
|
|
||||
| RUN4378 | MAT-POS-b3e365b9-1_1 |
|
EN300-85760_2_1_1 |
|
−0.6 ± 0.2 |
|
|
||||
| RUN5511 | MAT-POS-b3e365b9-1_1 |
|
JAG-UCB-706446eb-5_2_1 |
|
−0.6 ± 0.5 |
|
|
||||
| RUN1533 | MAT-POS-b3e365b9-1_1 |
|
ED_-GRI-5b13fbe2-49_2 |
|
−0.6 ± 0.4 |
|
|
||||
| RUN6029 | MAT-POS-b3e365b9-1_1 |
|
EN300-174603_4_1_1 |
|
−0.6 ± 0.4 |
|
|
||||
| RUN4083 | MAT-POS-b3e365b9-1_1 |
|
EN300-217107_3_4_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN1595 | MAT-POS-b3e365b9-1_1 |
|
EDG-MED-90036822-73_4 |
|
−0.6 ± 0.4 |
|
|
||||
| RUN5305 | MAT-POS-b3e365b9-1_1 |
|
EN300-299532_3_1_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN7143 | MAT-POS-b3e365b9-1_1 |
|
EN300-305294_1_3_1 |
|
−0.6 ± 0.2 |
|
|
||||
| RUN5791 | MAT-POS-b3e365b9-1_1 |
|
EN300-123398_1_2_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN439 | MAT-POS-b3e365b9-1_1 |
|
MAK-UNK-8be7dca9-1_1 |
|
−0.6 ± 0.1 |
|
|
||||
| RUN406 | MAT-POS-b3e365b9-1_1 |
|
DAR-DIA-23e5a6a0-9_1 |
|
−0.6 ± 0.4 |
|
|
||||
| RUN5766 | MAT-POS-b3e365b9-1_1 |
|
EN300-14767_3_2_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN6064 | MAT-POS-b3e365b9-1_1 |
|
EN300-1865348_3_1_1 |
|
−0.6 ± 0.4 |
|
|
||||
| RUN1303 | MAT-POS-b3e365b9-1_1 |
|
BEN-DND-a7517465-4_1 |
|
−0.56 ± 0.10 |
|
|
||||
| RUN7534 | MAT-POS-b3e365b9-1_1 |
|
EN300-6494158_2_3_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN1927 | MAT-POS-b3e365b9-1_1 |
|
RAL-THA-05e671eb-31_1 |
|
−0.6 ± 0.1 |
|
|
||||
| RUN5379 | MAT-POS-b3e365b9-1_1 |
|
EN300-385267_3_1_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN7763 | MAT-POS-b3e365b9-1_1 |
|
EN300-173006_4_2_1 |
|
−0.6 ± 0.4 |
|
|
||||
| RUN3278 | MAT-POS-b3e365b9-1_1 |
|
EN300-783124_3_4_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN7476 | MAT-POS-b3e365b9-1_1 |
|
EN300-104395_2_1_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN6453 | MAT-POS-b3e365b9-1_1 |
|
EN300-39405_1_2_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN6462 | MAT-POS-b3e365b9-1_1 |
|
EN300-261056_2_1_1 |
|
−0.6 ± 0.3 |
|
|
||||