| RUN | Initial microstate | Final microstate | ΔΔG / kcal M-1 | Work distribution | Convergence | ||||||
|---|---|---|---|---|---|---|---|---|---|---|---|
| RUN5016 | MAT-POS-b3e365b9-1_1 |
|
EN300-94900_2_1_1 |
|
−0.6 ± 0.4 |
|
|
||||
| RUN3053 | MAT-POS-b3e365b9-1_1 |
|
EN300-1387104_1_2_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN4324 | MAT-POS-b3e365b9-1_1 |
|
EN300-203118_1_1_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN2678 | MAT-POS-b3e365b9-1_1 |
|
EDJ-MED-ee07cf00-15_1 |
|
−0.6 ± 0.4 |
|
|
||||
| RUN6340 | MAT-POS-b3e365b9-1_1 |
|
EN300-42269_2_1_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN4755 | MAT-POS-b3e365b9-1_1 |
|
EN300-6082676_1_4_1 |
|
−0.6 ± 0.2 |
|
|
||||
| RUN4791 | MAT-POS-b3e365b9-1_1 |
|
EN300-105110_4_1_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN1427 | MAT-POS-b3e365b9-1_1 |
|
ED_-GRI-5b13fbe2-56_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN6738 | MAT-POS-b3e365b9-1_1 |
|
EN300-43047_1_1_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN5664 | MAT-POS-b3e365b9-1_1 |
|
EN300-203118_1_2_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN1721 | MAT-POS-b3e365b9-1_1 |
|
MAT-POS-281d2ee9-2_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN1339 | MAT-POS-b3e365b9-1_1 |
|
LAU-MED-88a3970a-5_1 |
|
−0.6 ± 0.2 |
|
|
||||
| RUN6251 | MAT-POS-b3e365b9-1_1 |
|
EN300-04491_3_1_1 |
|
−0.6 ± 0.5 |
|
|
||||
| RUN2384 | MAT-POS-b3e365b9-1_1 |
|
EDJ-MED-fcba3f31-4_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN5879 | MAT-POS-b3e365b9-1_1 |
|
EN300-210552_1_1_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN5896 | MAT-POS-b3e365b9-1_1 |
|
EN300-73507_1_1_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN2600 | MAT-POS-b3e365b9-1_1 |
|
ALP-UNI-dbbfd3db-4_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN4598 | MAT-POS-b3e365b9-1_1 |
|
EN300-221518_2_1_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN6079 | MAT-POS-b3e365b9-1_1 |
|
EN300-202922_2_2_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN5994 | MAT-POS-b3e365b9-1_1 |
|
EN300-23317_3_1_1 |
|
−0.6 ± 0.4 |
|
|
||||
| RUN3549 | MAT-POS-b3e365b9-1_1 |
|
EN300-149975_1_1_1 |
|
−0.6 ± 0.2 |
|
|
||||
| RUN5749 | MAT-POS-b3e365b9-1_1 |
|
EN300-1987964_1_1_1 |
|
−0.6 ± 0.4 |
|
|
||||
| RUN3479 | MAT-POS-b3e365b9-1_1 |
|
EN300-1664865_3_1_1 |
|
−0.6 ± 0.4 |
|
|
||||
| RUN6025 | MAT-POS-b3e365b9-1_1 |
|
EN300-6494158_2_2_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN6156 | MAT-POS-b3e365b9-1_1 |
|
EN300-295515_1_2_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN6452 | MAT-POS-b3e365b9-1_1 |
|
EN300-55087_1_1_1 |
|
−0.6 ± 0.4 |
|
|
||||
| RUN4205 | MAT-POS-b3e365b9-1_1 |
|
EN300-265285_2_2_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN4111 | MAT-POS-b3e365b9-1_1 |
|
EN300-132157_2_2_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN2616 | MAT-POS-b3e365b9-1_1 |
|
ALP-UNI-dbbfd3db-6_3 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN5507 | MAT-POS-b3e365b9-1_1 |
|
EN300-741822_1_2_1 |
|
−0.6 ± 0.2 |
|
|
||||
| RUN2044 | MAT-POS-b3e365b9-1_1 |
|
LEE-CAM-7ab9b158-1_7 |
|
−0.6 ± 0.4 |
|
|
||||
| RUN4759 | MAT-POS-b3e365b9-1_1 |
|
EN300-188582_1_1_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN1651 | MAT-POS-b3e365b9-1_1 |
|
EDG-MED-90036822-53_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN3566 | MAT-POS-b3e365b9-1_1 |
|
EN300-28871_1_1_1 |
|
−0.6 ± 0.2 |
|
|
||||
| RUN2553 | MAT-POS-b3e365b9-1_1 |
|
EDG-MED-ba1ac7b9-27_5 |
|
−0.6 ± 0.6 |
|
|
||||
| RUN5158 | MAT-POS-b3e365b9-1_1 |
|
EN300-6478432_1_1_1 |
|
−0.6 ± 0.4 |
|
|
||||
| RUN6610 | MAT-POS-b3e365b9-1_1 |
|
EN300-264301_2_1_1 |
|
−0.6 ± 0.2 |
|
|
||||
| RUN4486 | MAT-POS-b3e365b9-1_1 |
|
EN300-190283_3_1_1 |
|
−0.6 ± 0.4 |
|
|
||||
| RUN7517 | MAT-POS-b3e365b9-1_1 |
|
EN300-6082676_1_3_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN6925 | MAT-POS-b3e365b9-1_1 |
|
EN300-214038_2_2_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN1736 | MAT-POS-b3e365b9-1_1 |
|
PET-UNK-b87f07d0-4_1 |
|
−0.6 ± 0.5 |
|
|
||||
| RUN3837 | MAT-POS-b3e365b9-1_1 |
|
EN300-1604607_1_1_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN7459 | MAT-POS-b3e365b9-1_1 |
|
EN300-185378_1_1_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN4034 | MAT-POS-b3e365b9-1_1 |
|
EN300-43939_1_1_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN101 | MAT-POS-b3e365b9-1_1 |
|
MAT-POS-9ff17035-2_1 |
|
−0.6 ± 0.4 |
|
|
||||
| RUN5127 | MAT-POS-b3e365b9-1_1 |
|
EN300-14006_1_2_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN7000 | MAT-POS-b3e365b9-1_1 |
|
EN300-70033_2_1_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN7184 | MAT-POS-b3e365b9-1_1 |
|
EN300-100741_4_1_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN6104 | MAT-POS-b3e365b9-1_1 |
|
EN300-96362_1_2_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN5728 | MAT-POS-b3e365b9-1_1 |
|
EN300-124918_2_1_2 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN6808 | MAT-POS-b3e365b9-1_1 |
|
EN300-305996_1_1_1 |
|
−0.6 ± 0.2 |
|
|
||||
| RUN3792 | MAT-POS-b3e365b9-1_1 |
|
EN300-6736413_4_1_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN3268 | MAT-POS-b3e365b9-1_1 |
|
EN300-332601_1_2_1 |
|
−0.6 ± 0.2 |
|
|
||||
| RUN6317 | MAT-POS-b3e365b9-1_1 |
|
EN300-23019_2_1_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN1331 | MAT-POS-b3e365b9-1_1 |
|
DAR-DIA-9e4459de-13_8 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN4062 | MAT-POS-b3e365b9-1_1 |
|
EN300-34542_1_2_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN1589 | MAT-POS-b3e365b9-1_1 |
|
EDG-MED-90036822-37_2 |
|
−0.6 ± 0.2 |
|
|
||||
| RUN3984 | MAT-POS-b3e365b9-1_1 |
|
EN300-76205_3_1_1 |
|
−0.6 ± 0.5 |
|
|
||||
| RUN3759 | MAT-POS-b3e365b9-1_1 |
|
EN300-31184_1_2_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN5536 | MAT-POS-b3e365b9-1_1 |
|
EN300-83558_3_1_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN7339 | MAT-POS-b3e365b9-1_1 |
|
EN300-129424_1_1_1 |
|
−0.6 ± 0.2 |
|
|
||||
| RUN3050 | MAT-POS-b3e365b9-1_1 |
|
EN300-262204_3_1_1 |
|
−0.6 ± 0.5 |
|
|
||||
| RUN6386 | MAT-POS-b3e365b9-1_1 |
|
EN300-182084_3_1_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN5592 | MAT-POS-b3e365b9-1_1 |
|
EN300-54922_2_1_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN1447 | MAT-POS-b3e365b9-1_1 |
|
ED_-GRI-5b13fbe2-50_3 |
|
−0.6 ± 0.4 |
|
|
||||
| RUN2174 | MAT-POS-b3e365b9-1_1 |
|
ALF-EVA-5b152d2f-3_1 |
|
−0.6 ± 0.2 |
|
|
||||
| RUN5453 | MAT-POS-b3e365b9-1_1 |
|
EN300-66770_3_1_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN4668 | MAT-POS-b3e365b9-1_1 |
|
EN300-68203_1_2_1 |
|
−0.6 ± 0.2 |
|
|
||||
| RUN6174 | MAT-POS-b3e365b9-1_1 |
|
EN300-6494158_4_1_1 |
|
−0.6 ± 0.4 |
|
|
||||
| RUN563 | MAT-POS-b3e365b9-1_1 |
|
JAG-UCB-706446eb-8_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN7392 | MAT-POS-b3e365b9-1_1 |
|
EN300-14437_1_1_1 |
|
−0.6 ± 0.2 |
|
|
||||
| RUN1086 | MAT-POS-b3e365b9-1_1 |
|
BEN-DND-c852c98b-1_1 |
|
−0.61 ± 0.05 |
|
|
||||
| RUN3396 | MAT-POS-b3e365b9-1_1 |
|
EN300-6482296_3_8_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN4284 | MAT-POS-b3e365b9-1_1 |
|
EN300-259063_1_1_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN5509 | MAT-POS-b3e365b9-1_1 |
|
EN300-1241327_4_1_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN1352 | MAT-POS-b3e365b9-1_1 |
|
DAR-DIA-9e4459de-11_2 |
|
−0.6 ± 0.4 |
|
|
||||
| RUN2596 | MAT-POS-b3e365b9-1_1 |
|
EDG-MED-ba1ac7b9-23_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN6968 | MAT-POS-b3e365b9-1_1 |
|
EN300-6482296_2_4_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN5412 | MAT-POS-b3e365b9-1_1 |
|
EN300-70487_2_1_1 |
|
−0.6 ± 0.2 |
|
|
||||
| RUN5174 | MAT-POS-b3e365b9-1_1 |
|
EN300-30768_1_3_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN7418 | MAT-POS-b3e365b9-1_1 |
|
EN300-238405_1_1_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN5360 | MAT-POS-b3e365b9-1_1 |
|
EN300-30419_3_1_1 |
|
−0.6 ± 0.4 |
|
|
||||
| RUN1481 | MAT-POS-b3e365b9-1_1 |
|
ED_-GRI-5b13fbe2-67_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN3978 | MAT-POS-b3e365b9-1_1 |
|
EN300-198240_1_1_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN4132 | MAT-POS-b3e365b9-1_1 |
|
EN300-6970573_2_1_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN2347 | MAT-POS-b3e365b9-1_1 |
|
ALP-UNI-3496895b-15_7 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN4763 | MAT-POS-b3e365b9-1_1 |
|
EN300-1253122_1_1_1 |
|
−0.6 ± 0.2 |
|
|
||||
| RUN2453 | MAT-POS-b3e365b9-1_1 |
|
EDJ-MED-d203f206-32_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN1931 | MAT-POS-b3e365b9-1_1 |
|
DAR-DIA-6be260fc-4_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN5164 | MAT-POS-b3e365b9-1_1 |
|
EN300-1600786_2_1_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN4699 | MAT-POS-b3e365b9-1_1 |
|
EN300-317082_2_1_1 |
|
−0.6 ± 0.2 |
|
|
||||
| RUN6510 | MAT-POS-b3e365b9-1_1 |
|
EN300-255795_1_2_1 |
|
−0.6 ± 0.2 |
|
|
||||
| RUN4171 | MAT-POS-b3e365b9-1_1 |
|
EN300-122656_2_2_1 |
|
−0.6 ± 0.4 |
|
|
||||
| RUN7062 | MAT-POS-b3e365b9-1_1 |
|
EN300-7543132_1_1_1 |
|
−0.6 ± 0.4 |
|
|
||||
| RUN5177 | MAT-POS-b3e365b9-1_1 |
|
EN300-366050_1_1_1 |
|
−0.6 ± 0.2 |
|
|
||||
| RUN2310 | MAT-POS-b3e365b9-1_1 |
|
DAR-DIA-e7614d05-1_1 |
|
−0.6 ± 0.2 |
|
|
||||
| RUN6641 | MAT-POS-b3e365b9-1_1 |
|
EN300-21409_2_1_1 |
|
−0.6 ± 0.2 |
|
|
||||
| RUN6835 | MAT-POS-b3e365b9-1_1 |
|
EN300-77543_1_1_1 |
|
−0.6 ± 0.2 |
|
|
||||
| RUN5456 | MAT-POS-b3e365b9-1_1 |
|
EN300-10414_3_1_1 |
|
−0.6 ± 0.4 |
|
|
||||
| RUN4452 | MAT-POS-b3e365b9-1_1 |
|
EN300-71558_3_1_1 |
|
−0.6 ± 0.3 |
|
|
||||