| RUN | Initial microstate | Final microstate | ΔΔG / kcal M-1 | Work distribution | Convergence | ||||||
|---|---|---|---|---|---|---|---|---|---|---|---|
| RUN426 | MAT-POS-b3e365b9-1_1 |
|
EN300-71560_1_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN10687 | MAT-POS-b3e365b9-1_1 |
|
EN300-315792_4_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN10451 | MAT-POS-b3e365b9-1_1 |
|
EN300-6505003_4_3 |
|
−0.7 ± 0.4 |
|
|
||||
| RUN9841 | MAT-POS-b3e365b9-1_1 |
|
EN300-66494_4_1 |
|
−0.7 ± 0.4 |
|
|
||||
| RUN8730 | MAT-POS-b3e365b9-1_1 |
|
EN300-39151_1_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN3034 | MAT-POS-b3e365b9-1_1 |
|
EN300-126389_1_1 |
|
−0.7 ± 0.2 |
|
|
||||
| RUN4279 | MAT-POS-b3e365b9-1_1 |
|
EN300-126127_1_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN9977 | MAT-POS-b3e365b9-1_1 |
|
EN300-159953_1_1 |
|
−0.7 ± 0.4 |
|
|
||||
| RUN7728 | MAT-POS-b3e365b9-1_1 |
|
EN300-1587691_1_2 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN5626 | MAT-POS-b3e365b9-1_1 |
|
EN300-317085_1_1 |
|
−0.7 ± 0.2 |
|
|
||||
| RUN7340 | MAT-POS-b3e365b9-1_1 |
|
EN300-52768_3_1 |
|
−0.7 ± 0.5 |
|
|
||||
| RUN894 | MAT-POS-b3e365b9-1_1 |
|
EN300-17381_2_1 |
|
−0.7 ± 0.2 |
|
|
||||
| RUN9387 | MAT-POS-b3e365b9-1_1 |
|
EN300-7459540_2_1 |
|
−0.7 ± 0.4 |
|
|
||||
| RUN6991 | MAT-POS-b3e365b9-1_1 |
|
EN300-6759512_2_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN9480 | MAT-POS-b3e365b9-1_1 |
|
EN300-158272_3_1 |
|
−0.7 ± 0.4 |
|
|
||||
| RUN3921 | MAT-POS-b3e365b9-1_1 |
|
EN300-96362_1_2 |
|
−0.7 ± 0.4 |
|
|
||||
| RUN4135 | MAT-POS-b3e365b9-1_1 |
|
EN300-7448078_1_3 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN9001 | MAT-POS-b3e365b9-1_1 |
|
EN300-248888_4_2 |
|
−0.7 ± 0.4 |
|
|
||||
| RUN3770 | MAT-POS-b3e365b9-1_1 |
|
EN300-201551_2_2 |
|
−0.7 ± 0.4 |
|
|
||||
| RUN447 | MAT-POS-b3e365b9-1_1 |
|
EN300-95639_1_3 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN11186 | MAT-POS-b3e365b9-1_1 |
|
EN300-1273248_1_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN10505 | MAT-POS-b3e365b9-1_1 |
|
EN300-6505003_4_4 |
|
−0.7 ± 0.4 |
|
|
||||
| RUN577 | MAT-POS-b3e365b9-1_1 |
|
EN300-05620_1_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN9355 | MAT-POS-b3e365b9-1_1 |
|
EN300-250593_4_2 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN6369 | MAT-POS-b3e365b9-1_1 |
|
EN300-304695_3_2 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN3334 | MAT-POS-b3e365b9-1_1 |
|
EN300-97300_1_2 |
|
−0.7 ± 0.2 |
|
|
||||
| RUN4907 | MAT-POS-b3e365b9-1_1 |
|
EN300-104493_1_2 |
|
−0.7 ± 0.4 |
|
|
||||
| RUN8646 | MAT-POS-b3e365b9-1_1 |
|
EN300-2666482_1_1 |
|
−0.7 ± 0.2 |
|
|
||||
| RUN691 | MAT-POS-b3e365b9-1_1 |
|
EN300-1253122_4_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN7100 | MAT-POS-b3e365b9-1_1 |
|
EN300-1179673_3_1 |
|
−0.7 ± 0.4 |
|
|
||||
| RUN7856 | MAT-POS-b3e365b9-1_1 |
|
EN300-6478789_1_2 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN3208 | MAT-POS-b3e365b9-1_1 |
|
EN300-7443668_1_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN1983 | MAT-POS-b3e365b9-1_1 |
|
EN300-5638430_1_1 |
|
−0.7 ± 0.4 |
|
|
||||
| RUN574 | MAT-POS-b3e365b9-1_1 |
|
EN300-6486763_1_2 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN5954 | MAT-POS-b3e365b9-1_1 |
|
EN300-193679_1_2 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN866 | MAT-POS-b3e365b9-1_1 |
|
EN300-60862_1_2 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN2458 | MAT-POS-b3e365b9-1_1 |
|
EN300-1725538_2_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN3741 | MAT-POS-b3e365b9-1_1 |
|
EN300-107493_1_1 |
|
−0.7 ± 0.2 |
|
|
||||
| RUN675 | MAT-POS-b3e365b9-1_1 |
|
EN300-1911992_4_3 |
|
−0.7 ± 0.4 |
|
|
||||
| RUN4329 | MAT-POS-b3e365b9-1_1 |
|
EN300-6779469_1_3 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN6990 | MAT-POS-b3e365b9-1_1 |
|
EN300-135182_1_1 |
|
−0.7 ± 0.2 |
|
|
||||
| RUN5461 | MAT-POS-b3e365b9-1_1 |
|
EN300-2007564_2_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN4129 | MAT-POS-b3e365b9-1_1 |
|
EN300-97699_1_2 |
|
−0.7 ± 0.4 |
|
|
||||
| RUN1007 | MAT-POS-b3e365b9-1_1 |
|
EN300-6494158_4_1 |
|
−0.7 ± 0.4 |
|
|
||||
| RUN4955 | MAT-POS-b3e365b9-1_1 |
|
EN300-7353672_1_2 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN9212 | MAT-POS-b3e365b9-1_1 |
|
EN300-321597_4_1 |
|
−0.7 ± 0.4 |
|
|
||||
| RUN1382 | MAT-POS-b3e365b9-1_1 |
|
EN300-77092_2_1 |
|
−0.7 ± 0.2 |
|
|
||||
| RUN4769 | MAT-POS-b3e365b9-1_1 |
|
EN300-18569_1_1 |
|
−0.7 ± 0.2 |
|
|
||||
| RUN1823 | MAT-POS-b3e365b9-1_1 |
|
EN300-173006_1_2 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN9210 | MAT-POS-b3e365b9-1_1 |
|
EN300-1214616_2_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN9775 | MAT-POS-b3e365b9-1_1 |
|
EN300-316679_4_1 |
|
−0.7 ± 0.4 |
|
|
||||
| RUN8040 | MAT-POS-b3e365b9-1_1 |
|
EN300-318341_1_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN3929 | MAT-POS-b3e365b9-1_1 |
|
EN300-31015_1_1 |
|
−0.7 ± 0.2 |
|
|
||||
| RUN5624 | MAT-POS-b3e365b9-1_1 |
|
EN300-33601_1_2 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN6855 | MAT-POS-b3e365b9-1_1 |
|
EN300-21200_2_1 |
|
−0.7 ± 0.2 |
|
|
||||
| RUN5187 | MAT-POS-b3e365b9-1_1 |
|
EN300-295515_1_2 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN3947 | MAT-POS-b3e365b9-1_1 |
|
EN300-120068_3_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN9068 | MAT-POS-b3e365b9-1_1 |
|
EN300-14949_1_1 |
|
−0.7 ± 0.2 |
|
|
||||
| RUN7397 | MAT-POS-b3e365b9-1_1 |
|
EN300-173020_2_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN3670 | MAT-POS-b3e365b9-1_1 |
|
EN300-199359_1_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN6080 | MAT-POS-b3e365b9-1_1 |
|
EN300-75807_1_1 |
|
−0.7 ± 0.2 |
|
|
||||
| RUN1362 | MAT-POS-b3e365b9-1_1 |
|
EN300-2972220_3_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN8258 | MAT-POS-b3e365b9-1_1 |
|
EN300-7445540_1_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN7455 | MAT-POS-b3e365b9-1_1 |
|
EN300-7543132_2_1 |
|
−0.7 ± 0.4 |
|
|
||||
| RUN10140 | MAT-POS-b3e365b9-1_1 |
|
EN300-259694_4_1 |
|
−0.7 ± 0.5 |
|
|
||||
| RUN378 | MAT-POS-b3e365b9-1_1 |
|
EN300-104592_1_2 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN7816 | MAT-POS-b3e365b9-1_1 |
|
EN300-7355477_1_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN148 | MAT-POS-b3e365b9-1_1 |
|
DAR-DIA-23e5a6a0-4_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN852 | MAT-POS-b3e365b9-1_1 |
|
EN300-22880_3_2 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN6537 | MAT-POS-b3e365b9-1_1 |
|
EN300-158274_3_1 |
|
−0.7 ± 0.4 |
|
|
||||
| RUN6961 | MAT-POS-b3e365b9-1_1 |
|
EN300-75030_2_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN2269 | MAT-POS-b3e365b9-1_1 |
|
EN300-202757_2_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN926 | MAT-POS-b3e365b9-1_1 |
|
EN300-65839_2_2 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN9494 | MAT-POS-b3e365b9-1_1 |
|
EN300-53677_3_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN3307 | MAT-POS-b3e365b9-1_1 |
|
EN300-31969_2_1 |
|
−0.7 ± 0.4 |
|
|
||||
| RUN2978 | MAT-POS-b3e365b9-1_1 |
|
EN300-1452069_1_2 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN9278 | MAT-POS-b3e365b9-1_1 |
|
EN300-373446_1_1 |
|
−0.7 ± 0.4 |
|
|
||||
| RUN11134 | MAT-POS-b3e365b9-1_1 |
|
EN300-257573_1_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN2419 | MAT-POS-b3e365b9-1_1 |
|
EN300-04491_3_1 |
|
−0.7 ± 0.5 |
|
|
||||
| RUN4998 | MAT-POS-b3e365b9-1_1 |
|
EN300-61636_2_1 |
|
−0.7 ± 0.4 |
|
|
||||
| RUN2603 | MAT-POS-b3e365b9-1_1 |
|
EN300-7457160_2_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN9061 | MAT-POS-b3e365b9-1_1 |
|
EN300-21303_4_1 |
|
−0.7 ± 0.4 |
|
|
||||
| RUN8 | MAT-POS-b3e365b9-1_1 |
|
EDJ-MED-e4b030d8-13_1 |
|
−0.68 ± 0.09 |
|
|
||||
| RUN4517 | MAT-POS-b3e365b9-1_1 |
|
EN300-31146_1_1 |
|
−0.7 ± 0.4 |
|
|
||||
| RUN1649 | MAT-POS-b3e365b9-1_1 |
|
EN300-182913_3_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN10298 | MAT-POS-b3e365b9-1_1 |
|
EN300-7102031_3_1 |
|
−0.7 ± 0.5 |
|
|
||||
| RUN8531 | MAT-POS-b3e365b9-1_1 |
|
EN300-147397_2_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN8049 | MAT-POS-b3e365b9-1_1 |
|
EN300-155447_2_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN8455 | MAT-POS-b3e365b9-1_1 |
|
EN300-83529_2_1 |
|
−0.7 ± 0.2 |
|
|
||||
| RUN133 | MAT-POS-b3e365b9-1_1 |
|
DAR-DIA-23e5a6a0-6_2 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN8678 | MAT-POS-b3e365b9-1_1 |
|
EN300-181178_1_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN9675 | MAT-POS-b3e365b9-1_1 |
|
EN300-10397_4_1 |
|
−0.7 ± 0.2 |
|
|
||||
| RUN2945 | MAT-POS-b3e365b9-1_1 |
|
EN300-1605226_2_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN6723 | MAT-POS-b3e365b9-1_1 |
|
EN300-66764_1_4 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN10493 | MAT-POS-b3e365b9-1_1 |
|
EN300-14752_4_1 |
|
−0.7 ± 0.4 |
|
|
||||
| RUN3654 | MAT-POS-b3e365b9-1_1 |
|
EN300-155589_1_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN7353 | MAT-POS-b3e365b9-1_1 |
|
EN300-371704_2_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN9610 | MAT-POS-b3e365b9-1_1 |
|
EN300-1720418_1_1 |
|
−0.7 ± 0.2 |
|
|
||||
| RUN9762 | MAT-POS-b3e365b9-1_1 |
|
EN300-262389_1_1 |
|
−0.7 ± 0.3 |
|
|
||||
| RUN1734 | MAT-POS-b3e365b9-1_1 |
|
EN300-226314_4_1 |
|
−0.7 ± 0.4 |
|
|
||||