| RUN | Initial microstate | Final microstate | ΔΔG / kcal M-1 | Work distribution | Convergence | ||||||
|---|---|---|---|---|---|---|---|---|---|---|---|
| RUN4352 | MAT-POS-b3e365b9-1_1 |
|
EN300-3044054_1_2_1 |
|
0.0 ± 0.2 |
|
|
||||
| RUN1257 | MAT-POS-b3e365b9-1_1 |
|
DAR-DIA-5ff57136-5_1 |
|
0.0 ± 0.4 |
|
|
||||
| RUN1635 | MAT-POS-b3e365b9-1_1 |
|
EDG-MED-90036822-54_1 |
|
0.0 ± 0.2 |
|
|
||||
| RUN6935 | MAT-POS-b3e365b9-1_1 |
|
EN300-7471076_2_3_1 |
|
0.0 ± 0.3 |
|
|
||||
| RUN4942 | MAT-POS-b3e365b9-1_1 |
|
EN300-73772_4_1_2 |
|
0.0 ± 0.4 |
|
|
||||
| RUN6787 | MAT-POS-b3e365b9-1_1 |
|
EN300-72896_2_1_1 |
|
0.0 ± 0.2 |
|
|
||||
| RUN3889 | MAT-POS-b3e365b9-1_1 |
|
EN300-6792206_3_1_1 |
|
0.0 ± 0.4 |
|
|
||||
| RUN7771 | MAT-POS-b3e365b9-1_1 |
|
EN300-172485_2_1_1 |
|
0.0 ± 0.2 |
|
|
||||
| RUN1492 | MAT-POS-b3e365b9-1_1 |
|
EDG-MED-4c68219f-10_1 |
|
0.0 ± 0.4 |
|
|
||||
| RUN527 | MAT-POS-b3e365b9-1_1 |
|
ADA-UCB-dc2b944c-15_1 |
|
0.0 ± 0.2 |
|
|
||||
| RUN5337 | MAT-POS-b3e365b9-1_1 |
|
EN300-92790_2_1_1 |
|
0.0 ± 0.3 |
|
|
||||
| RUN5996 | MAT-POS-b3e365b9-1_1 |
|
EN300-69556_1_1_1 |
|
0.0 ± 0.3 |
|
|
||||
| RUN7291 | MAT-POS-b3e365b9-1_1 |
|
EN300-124904_2_1_1 |
|
0.0 ± 0.3 |
|
|
||||
| RUN5451 | MAT-POS-b3e365b9-1_1 |
|
EN300-1703852_2_1_1 |
|
0.0 ± 0.2 |
|
|
||||
| RUN5289 | MAT-POS-b3e365b9-1_1 |
|
EN300-263153_2_1_1 |
|
0.0 ± 0.3 |
|
|
||||
| RUN145 | MAT-POS-b3e365b9-1_1 |
|
MIC-UNK-d36ab305-4_1 |
|
0.0 ± 0.3 |
|
|
||||
| RUN6642 | MAT-POS-b3e365b9-1_1 |
|
EN300-194132_2_1_1 |
|
0.0 ± 0.3 |
|
|
||||
| RUN3543 | MAT-POS-b3e365b9-1_1 |
|
EN300-6277108_1_1_1 |
|
0.0 ± 0.3 |
|
|
||||
| RUN1922 | MAT-POS-b3e365b9-1_1 |
|
RAL-THA-05e671eb-29_1 |
|
0.05 ± 0.07 |
|
|
||||
| RUN578 | MAT-POS-b3e365b9-1_1 |
|
ADA-UCB-dc2b944c-17_1 |
|
0.0 ± 0.6 |
|
|
||||
| RUN3874 | MAT-POS-b3e365b9-1_1 |
|
EN300-248526_1_2_1 |
|
0.1 ± 0.3 |
|
|
||||
| RUN6258 | MAT-POS-b3e365b9-1_1 |
|
EN300-123400_1_1_1 |
|
0.1 ± 0.2 |
|
|
||||
| RUN6790 | MAT-POS-b3e365b9-1_1 |
|
EN300-203853_1_1_1 |
|
0.1 ± 0.4 |
|
|
||||
| RUN6536 | MAT-POS-b3e365b9-1_1 |
|
EN300-7355835_1_1_1 |
|
0.1 ± 0.3 |
|
|
||||
| RUN5067 | MAT-POS-b3e365b9-1_1 |
|
EN300-1662365_2_1_1 |
|
0.1 ± 0.3 |
|
|
||||
| RUN4901 | MAT-POS-b3e365b9-1_1 |
|
EN300-785910_2_1_1 |
|
0.1 ± 0.3 |
|
|
||||
| RUN6882 | MAT-POS-b3e365b9-1_1 |
|
EN300-117931_4_1_1 |
|
0.1 ± 0.3 |
|
|
||||
| RUN3840 | MAT-POS-b3e365b9-1_1 |
|
EN300-7456499_2_1_1 |
|
0.1 ± 0.5 |
|
|
||||
| RUN7612 | MAT-POS-b3e365b9-1_1 |
|
EN300-108022_1_1_1 |
|
0.1 ± 0.2 |
|
|
||||
| RUN2550 | MAT-POS-b3e365b9-1_1 |
|
EDG-MED-ba1ac7b9-25_7 |
|
0.1 ± 0.6 |
|
|
||||
| RUN6120 | MAT-POS-b3e365b9-1_1 |
|
EN300-75807_1_1_1 |
|
0.1 ± 0.2 |
|
|
||||
| RUN7204 | MAT-POS-b3e365b9-1_1 |
|
EN300-14006_1_1_1 |
|
0.1 ± 0.3 |
|
|
||||
| RUN1329 | MAT-POS-b3e365b9-1_1 |
|
DAR-DIA-9e4459de-13_9 |
|
0.1 ± 0.5 |
|
|
||||
| RUN7201 | MAT-POS-b3e365b9-1_1 |
|
EN300-139167_2_2_1 |
|
0.1 ± 0.3 |
|
|
||||
| RUN7188 | MAT-POS-b3e365b9-1_1 |
|
EN300-00271_4_2_1 |
|
0.1 ± 0.4 |
|
|
||||
| RUN7055 | MAT-POS-b3e365b9-1_1 |
|
EN300-396329_2_1_1 |
|
0.1 ± 0.3 |
|
|
||||
| RUN268 | MAT-POS-b3e365b9-1_1 |
|
DAR-DIA-6a508060-11_3 |
|
0.1 ± 0.3 |
|
|
||||
| RUN5714 | MAT-POS-b3e365b9-1_1 |
|
EN300-314455_1_1_1 |
|
0.1 ± 0.3 |
|
|
||||
| RUN4882 | MAT-POS-b3e365b9-1_1 |
|
EN300-6505003_3_2_1 |
|
0.1 ± 0.3 |
|
|
||||
| RUN1025 | MAT-POS-b3e365b9-1_1 |
|
BEN-BAS-c2bc0d80-2_2 |
|
0.1 ± 0.3 |
|
|
||||
| RUN7596 | MAT-POS-b3e365b9-1_1 |
|
EN300-1588613_1_1_1 |
|
0.1 ± 0.3 |
|
|
||||
| RUN5070 | MAT-POS-b3e365b9-1_1 |
|
EN300-1719143_1_1_1 |
|
0.1 ± 0.3 |
|
|
||||
| RUN6451 | MAT-POS-b3e365b9-1_1 |
|
EN300-1911992_1_1_1 |
|
0.1 ± 0.3 |
|
|
||||
| RUN8 | MAT-POS-b3e365b9-1_1 |
|
DAR-DIA-0cde14eb-46_1 |
|
0.1 ± 0.3 |
|
|
||||
| RUN5139 | MAT-POS-b3e365b9-1_1 |
|
EN300-217107_2_4_1 |
|
0.1 ± 0.3 |
|
|
||||
| RUN5242 | MAT-POS-b3e365b9-1_1 |
|
EN300-92633_1_2_1 |
|
0.1 ± 0.3 |
|
|
||||
| RUN6107 | MAT-POS-b3e365b9-1_1 |
|
EN300-7432415_1_1_1 |
|
0.1 ± 0.2 |
|
|
||||
| RUN1011 | MAT-POS-b3e365b9-1_1 |
|
BEN-BAS-c2bc0d80-5_1 |
|
0.1 ± 0.3 |
|
|
||||
| RUN5635 | MAT-POS-b3e365b9-1_1 |
|
EN300-379533_1_1_1 |
|
0.1 ± 0.3 |
|
|
||||
| RUN1756 | MAT-POS-b3e365b9-1_1 |
|
JOH-UNI-3fc3434e-6_1 |
|
0.1 ± 0.3 |
|
|
||||
| RUN357 | MAT-POS-b3e365b9-1_1 |
|
DAR-DIA-23e5a6a0-5_2 |
|
0.1 ± 0.3 |
|
|
||||
| RUN6420 | MAT-POS-b3e365b9-1_1 |
|
EN300-216594_2_1_1 |
|
0.1 ± 0.3 |
|
|
||||
| RUN6487 | MAT-POS-b3e365b9-1_1 |
|
EN300-171215_1_2_1 |
|
0.1 ± 0.3 |
|
|
||||
| RUN332 | MAT-POS-b3e365b9-1_1 |
|
FRA-DIA-b66f7109-2_2 |
|
0.1 ± 0.3 |
|
|
||||
| RUN4705 | MAT-POS-b3e365b9-1_1 |
|
MAK-UNK-8be7dca9-1_1_1 |
|
0.1 ± 0.1 |
|
|
||||
| RUN1189 | MAT-POS-b3e365b9-1_1 |
|
RAL-THA-8416115c-13_3 |
|
0.1 ± 0.3 |
|
|
||||
| RUN5410 | MAT-POS-b3e365b9-1_1 |
|
EN300-7464289_1_1_1 |
|
0.1 ± 0.3 |
|
|
||||
| RUN6975 | MAT-POS-b3e365b9-1_1 |
|
EN300-6729572_4_1_1 |
|
0.1 ± 0.4 |
|
|
||||
| RUN1109 | MAT-POS-b3e365b9-1_1 |
|
RAL-THA-4aa06b95-2_1 |
|
0.1 ± 0.3 |
|
|
||||
| RUN7276 | MAT-POS-b3e365b9-1_1 |
|
EN300-148865_2_1_1 |
|
0.1 ± 0.3 |
|
|
||||
| RUN5489 | MAT-POS-b3e365b9-1_1 |
|
EN300-86282_2_1_1 |
|
0.1 ± 0.3 |
|
|
||||
| RUN6245 | MAT-POS-b3e365b9-1_1 |
|
EN300-297611_1_2_1 |
|
0.1 ± 0.4 |
|
|
||||
| RUN7527 | MAT-POS-b3e365b9-1_1 |
|
EN300-39785_2_1_1 |
|
0.1 ± 0.3 |
|
|
||||
| RUN7783 | MAT-POS-b3e365b9-1_1 |
|
EDJ-MED-28ec730d-3_1_1 |
|
0.1 ± 0.2 |
|
|
||||
| RUN6785 | MAT-POS-b3e365b9-1_1 |
|
EN300-311920_2_1_1 |
|
0.1 ± 0.2 |
|
|
||||
| RUN3039 | MAT-POS-b3e365b9-1_1 |
|
EN300-754584_1_1_1 |
|
0.1 ± 0.3 |
|
|
||||
| RUN7018 | MAT-POS-b3e365b9-1_1 |
|
EN300-383664_1_1_1 |
|
0.1 ± 0.2 |
|
|
||||
| RUN5814 | MAT-POS-b3e365b9-1_1 |
|
EN300-20284_2_2_1 |
|
0.1 ± 0.2 |
|
|
||||
| RUN4135 | MAT-POS-b3e365b9-1_1 |
|
EN300-155498_3_1_1 |
|
0.1 ± 0.3 |
|
|
||||
| RUN6652 | MAT-POS-b3e365b9-1_1 |
|
EN300-190353_1_1_1 |
|
0.1 ± 0.3 |
|
|
||||
| RUN6372 | MAT-POS-b3e365b9-1_1 |
|
EN300-1272704_1_1_1 |
|
0.1 ± 0.3 |
|
|
||||
| RUN5830 | MAT-POS-b3e365b9-1_1 |
|
EN300-91905_2_1_1 |
|
0.1 ± 0.2 |
|
|
||||
| RUN379 | MAT-POS-b3e365b9-1_1 |
|
DAR-DIA-23e5a6a0-6_2 |
|
0.1 ± 0.3 |
|
|
||||
| RUN1079 | MAT-POS-b3e365b9-1_1 |
|
ALP-POS-966f8da6-2_2 |
|
0.1 ± 0.3 |
|
|
||||
| RUN2033 | MAT-POS-b3e365b9-1_1 |
|
MAT-POS-de59a476-1_1 |
|
0.1 ± 0.3 |
|
|
||||
| RUN2526 | MAT-POS-b3e365b9-1_1 |
|
EDG-MED-ba1ac7b9-16_2 |
|
0.1 ± 0.4 |
|
|
||||
| RUN1557 | MAT-POS-b3e365b9-1_1 |
|
EDG-MED-90036822-1_1 |
|
0.1 ± 0.3 |
|
|
||||
| RUN4917 | MAT-POS-b3e365b9-1_1 |
|
EN300-1448674_1_1_1 |
|
0.1 ± 0.3 |
|
|
||||
| RUN5684 | MAT-POS-b3e365b9-1_1 |
|
EN300-68794_3_1_1 |
|
0.1 ± 0.3 |
|
|
||||
| RUN5459 | MAT-POS-b3e365b9-1_1 |
|
EN300-7436306_4_1_1 |
|
0.1 ± 0.4 |
|
|
||||
| RUN5603 | MAT-POS-b3e365b9-1_1 |
|
EN300-98038_1_1_2 |
|
0.1 ± 0.3 |
|
|
||||
| RUN836 | MAT-POS-b3e365b9-1_1 |
|
MAK-UNK-c749d764-8_7 |
|
0.1 ± 0.3 |
|
|
||||
| RUN3095 | MAT-POS-b3e365b9-1_1 |
|
EN300-225560_1_1_1 |
|
0.1 ± 0.2 |
|
|
||||
| RUN5694 | MAT-POS-b3e365b9-1_1 |
|
EN300-251851_1_1_1 |
|
0.1 ± 0.2 |
|
|
||||
| RUN5775 | MAT-POS-b3e365b9-1_1 |
|
EN300-77464_2_1_1 |
|
0.1 ± 0.2 |
|
|
||||
| RUN6051 | MAT-POS-b3e365b9-1_1 |
|
EN300-47606_3_1_1 |
|
0.1 ± 0.4 |
|
|
||||
| RUN6197 | MAT-POS-b3e365b9-1_1 |
|
EN300-33478_1_2_1 |
|
0.1 ± 0.3 |
|
|
||||
| RUN7804 | MAT-POS-b3e365b9-1_1 |
|
EN300-43090_2_1_1 |
|
0.1 ± 0.2 |
|
|
||||
| RUN7779 | MAT-POS-b3e365b9-1_1 |
|
EN300-7438575_2_1_2 |
|
0.1 ± 0.3 |
|
|
||||
| RUN4040 | MAT-POS-b3e365b9-1_1 |
|
EN300-99983_2_1_1 |
|
0.1 ± 0.3 |
|
|
||||
| RUN1648 | MAT-POS-b3e365b9-1_1 |
|
EDG-MED-90036822-81_2 |
|
0.1 ± 0.3 |
|
|
||||
| RUN2687 | MAT-POS-b3e365b9-1_1 |
|
EDJ-MED-ee07cf00-11_2 |
|
0.1 ± 0.6 |
|
|
||||
| RUN4045 | MAT-POS-b3e365b9-1_1 |
|
EN300-269453_2_2_1 |
|
0.1 ± 0.3 |
|
|
||||
| RUN6031 | MAT-POS-b3e365b9-1_1 |
|
EN300-178515_3_1_1 |
|
0.1 ± 0.3 |
|
|
||||
| RUN7199 | MAT-POS-b3e365b9-1_1 |
|
EN300-16216_1_1_1 |
|
0.1 ± 0.2 |
|
|
||||
| RUN7290 | MAT-POS-b3e365b9-1_1 |
|
EN300-7465104_1_1_1 |
|
0.1 ± 0.3 |
|
|
||||
| RUN575 | MAT-POS-b3e365b9-1_1 |
|
VLA-UCB-34f3ed0c-13_1 |
|
0.1 ± 0.4 |
|
|
||||
| RUN7782 | MAT-POS-b3e365b9-1_1 |
|
EN300-46832_2_2_1 |
|
0.1 ± 0.3 |
|
|
||||
| RUN3751 | MAT-POS-b3e365b9-1_1 |
|
EN300-1605566_1_1_1 |
|
0.1 ± 0.4 |
|
|
||||
| RUN327 | MAT-POS-b3e365b9-1_1 |
|
FRA-DIA-b66f7109-1_1 |
|
0.1 ± 0.3 |
|
|
||||