| RUN | Initial microstate | Final microstate | ΔΔG / kcal M-1 | Work distribution | Convergence | ||||||
|---|---|---|---|---|---|---|---|---|---|---|---|
| RUN3618 | MAT-POS-b3e365b9-1_1 |
|
EN300-7430501_3_1_1 |
|
−1.5 ± 0.4 |
|
|
||||
| RUN2709 | MAT-POS-b3e365b9-1_1 |
|
EN300-122656_1_2_1 |
|
−1.5 ± 0.4 |
|
|
||||
| RUN3719 | MAT-POS-b3e365b9-1_1 |
|
EN300-247951_1_1_1 |
|
−1.5 ± 0.2 |
|
|
||||
| RUN4117 | MAT-POS-b3e365b9-1_1 |
|
EN300-6736413_2_2_1 |
|
−1.5 ± 0.2 |
|
|
||||
| RUN278 | MAT-POS-b3e365b9-1_1 |
|
EDJ-MED-e4b030d8-4_1 |
|
−1.5 ± 0.2 |
|
|
||||
| RUN5792 | MAT-POS-b3e365b9-1_1 |
|
EN300-42154_1_1_1 |
|
−1.5 ± 0.4 |
|
|
||||
| RUN2047 | MAT-POS-b3e365b9-1_1 |
|
ALP-UNI-76695c4f-8_2 |
|
−1.5 ± 0.3 |
|
|
||||
| RUN3241 | MAT-POS-b3e365b9-1_1 |
|
EN300-6745081_3_2_1 |
|
−1.5 ± 0.4 |
|
|
||||
| RUN3183 | MAT-POS-b3e365b9-1_1 |
|
EN300-1719432_1_1_1 |
|
−1.5 ± 0.3 |
|
|
||||
| RUN6566 | MAT-POS-b3e365b9-1_1 |
|
EN300-312618_1_1_1 |
|
−1.5 ± 0.2 |
|
|
||||
| RUN6307 | MAT-POS-b3e365b9-1_1 |
|
EN300-263346_1_1_1 |
|
−1.5 ± 0.3 |
|
|
||||
| RUN7657 | MAT-POS-b3e365b9-1_1 |
|
EN300-331828_1_1_1 |
|
−1.5 ± 0.2 |
|
|
||||
| RUN3722 | MAT-POS-b3e365b9-1_1 |
|
EN300-331828_4_1_1 |
|
−1.5 ± 0.3 |
|
|
||||
| RUN6794 | MAT-POS-b3e365b9-1_1 |
|
EN300-173562_2_3_1 |
|
−1.5 ± 0.3 |
|
|
||||
| RUN6181 | MAT-POS-b3e365b9-1_1 |
|
EN300-120068_3_1_1 |
|
−1.5 ± 0.3 |
|
|
||||
| RUN4325 | MAT-POS-b3e365b9-1_1 |
|
EN300-11195_3_1_1 |
|
−1.5 ± 0.2 |
|
|
||||
| RUN1450 | MAT-POS-b3e365b9-1_1 |
|
ED_-GRI-5b13fbe2-60_2 |
|
−1.5 ± 0.4 |
|
|
||||
| RUN4148 | MAT-POS-b3e365b9-1_1 |
|
EN300-1452069_1_1_1 |
|
−1.5 ± 0.3 |
|
|
||||
| RUN7682 | MAT-POS-b3e365b9-1_1 |
|
EN300-39005_1_1_1 |
|
−1.5 ± 0.2 |
|
|
||||
| RUN4271 | MAT-POS-b3e365b9-1_1 |
|
MAK-UNK-83e0a0b4-4_1_1 |
|
−1.5 ± 0.4 |
|
|
||||
| RUN6811 | MAT-POS-b3e365b9-1_1 |
|
EN300-245036_1_1_1 |
|
−1.5 ± 0.3 |
|
|
||||
| RUN3557 | MAT-POS-b3e365b9-1_1 |
|
EN300-95507_1_1_1 |
|
−1.5 ± 0.2 |
|
|
||||
| RUN1551 | MAT-POS-b3e365b9-1_1 |
|
EDG-MED-90036822-37_1 |
|
−1.5 ± 0.2 |
|
|
||||
| RUN5628 | MAT-POS-b3e365b9-1_1 |
|
EN300-299532_3_2_1 |
|
−1.5 ± 0.3 |
|
|
||||
| RUN5033 | MAT-POS-b3e365b9-1_1 |
|
EN300-104029_1_2_1 |
|
−1.5 ± 0.2 |
|
|
||||
| RUN3359 | MAT-POS-b3e365b9-1_1 |
|
EN300-217343_2_1_1 |
|
−1.5 ± 0.4 |
|
|
||||
| RUN7072 | MAT-POS-b3e365b9-1_1 |
|
EN300-53395_3_1_1 |
|
−1.5 ± 0.4 |
|
|
||||
| RUN6837 | MAT-POS-b3e365b9-1_1 |
|
EN300-783124_2_4_1 |
|
−1.5 ± 0.2 |
|
|
||||
| RUN7075 | MAT-POS-b3e365b9-1_1 |
|
EN300-61898_1_1_1 |
|
−1.5 ± 0.3 |
|
|
||||
| RUN4748 | MAT-POS-b3e365b9-1_1 |
|
EN300-76205_1_1_1 |
|
−1.5 ± 0.3 |
|
|
||||
| RUN7576 | MAT-POS-b3e365b9-1_1 |
|
EN300-173562_2_3_1 |
|
−1.5 ± 0.3 |
|
|
||||
| RUN3717 | MAT-POS-b3e365b9-1_1 |
|
EN300-1241327_3_1_1 |
|
−1.5 ± 0.3 |
|
|
||||
| RUN4932 | MAT-POS-b3e365b9-1_1 |
|
EN300-704025_3_1_1 |
|
−1.5 ± 0.4 |
|
|
||||
| RUN5457 | MAT-POS-b3e365b9-1_1 |
|
EN300-185751_3_1_1 |
|
−1.5 ± 0.3 |
|
|
||||
| RUN5804 | MAT-POS-b3e365b9-1_1 |
|
EN300-202757_1_1_1 |
|
−1.5 ± 0.3 |
|
|
||||
| RUN7796 | MAT-POS-b3e365b9-1_1 |
|
EN300-1706036_1_1_1 |
|
−1.5 ± 0.3 |
|
|
||||
| RUN4094 | MAT-POS-b3e365b9-1_1 |
|
EN300-206592_3_1_1 |
|
−1.5 ± 0.3 |
|
|
||||
| RUN3176 | MAT-POS-b3e365b9-1_1 |
|
EN300-1700760_1_1_1 |
|
−1.5 ± 0.2 |
|
|
||||
| RUN5580 | MAT-POS-b3e365b9-1_1 |
|
EN300-151461_1_2_1 |
|
−1.5 ± 0.2 |
|
|
||||
| RUN4577 | MAT-POS-b3e365b9-1_1 |
|
EN300-201553_3_1_1 |
|
−1.5 ± 0.3 |
|
|
||||
| RUN3047 | MAT-POS-b3e365b9-1_1 |
|
EN300-6745453_3_2_1 |
|
−1.5 ± 0.4 |
|
|
||||
| RUN4590 | MAT-POS-b3e365b9-1_1 |
|
EN300-2958082_1_1_1 |
|
−1.5 ± 0.3 |
|
|
||||
| RUN3739 | MAT-POS-b3e365b9-1_1 |
|
EN300-307084_1_1_1 |
|
−1.5 ± 0.3 |
|
|
||||
| RUN3748 | MAT-POS-b3e365b9-1_1 |
|
EN300-206592_1_2_1 |
|
−1.5 ± 0.4 |
|
|
||||
| RUN5898 | MAT-POS-b3e365b9-1_1 |
|
EN300-2977549_1_1_1 |
|
−1.5 ± 0.2 |
|
|
||||
| RUN5875 | MAT-POS-b3e365b9-1_1 |
|
EN300-67073_3_1_1 |
|
−1.5 ± 0.4 |
|
|
||||
| RUN5333 | MAT-POS-b3e365b9-1_1 |
|
EN300-38979_3_1_1 |
|
−1.5 ± 0.3 |
|
|
||||
| RUN4079 | MAT-POS-b3e365b9-1_1 |
|
EN300-79588_3_1_1 |
|
−1.5 ± 0.3 |
|
|
||||
| RUN4651 | MAT-POS-b3e365b9-1_1 |
|
EN300-05512_3_1_1 |
|
−1.5 ± 0.4 |
|
|
||||
| RUN5088 | MAT-POS-b3e365b9-1_1 |
|
EN300-100916_4_1_1 |
|
−1.5 ± 0.3 |
|
|
||||
| RUN620 | MAT-POS-b3e365b9-1_1 |
|
JAG-UCB-706446eb-4_1 |
|
−1.5 ± 0.2 |
|
|
||||
| RUN6676 | MAT-POS-b3e365b9-1_1 |
|
EN300-6493972_3_1_1 |
|
−1.5 ± 0.2 |
|
|
||||
| RUN7306 | MAT-POS-b3e365b9-1_1 |
|
EN300-1608590_2_1_1 |
|
−1.5 ± 0.3 |
|
|
||||
| RUN1449 | MAT-POS-b3e365b9-1_1 |
|
ED_-GRI-5b13fbe2-35_1 |
|
−1.5 ± 0.3 |
|
|
||||
| RUN4411 | MAT-POS-b3e365b9-1_1 |
|
EN300-141628_1_1_1 |
|
−1.5 ± 0.4 |
|
|
||||
| RUN5213 | MAT-POS-b3e365b9-1_1 |
|
EN300-184446_1_1_1 |
|
−1.5 ± 0.3 |
|
|
||||
| RUN2436 | MAT-POS-b3e365b9-1_1 |
|
EDJ-MED-d203f206-38_1 |
|
−1.5 ± 0.4 |
|
|
||||
| RUN7641 | MAT-POS-b3e365b9-1_1 |
|
EN300-7461023_2_1_1 |
|
−1.5 ± 0.3 |
|
|
||||
| RUN4999 | MAT-POS-b3e365b9-1_1 |
|
EN300-50631_1_1_1 |
|
−1.5 ± 0.3 |
|
|
||||
| RUN6270 | MAT-POS-b3e365b9-1_1 |
|
EN300-7102031_3_1_1 |
|
−1.5 ± 0.5 |
|
|
||||
| RUN5834 | MAT-POS-b3e365b9-1_1 |
|
EN300-120569_1_1_1 |
|
−1.5 ± 0.3 |
|
|
||||
| RUN3573 | MAT-POS-b3e365b9-1_1 |
|
EN300-7385329_1_2_1 |
|
−1.5 ± 0.3 |
|
|
||||
| RUN558 | MAT-POS-b3e365b9-1_1 |
|
MIC-UNK-50cce87d-8_1 |
|
−1.5 ± 0.2 |
|
|
||||
| RUN4285 | MAT-POS-b3e365b9-1_1 |
|
EN300-217107_3_2_1 |
|
−1.5 ± 0.3 |
|
|
||||
| RUN6196 | MAT-POS-b3e365b9-1_1 |
|
EN300-310022_1_1_1 |
|
−1.5 ± 0.3 |
|
|
||||
| RUN2285 | MAT-POS-b3e365b9-1_1 |
|
ALP-POS-2da19ca7-7_8 |
|
−1.4 ± 0.4 |
|
|
||||
| RUN3319 | MAT-POS-b3e365b9-1_1 |
|
EN300-05620_3_1_1 |
|
−1.4 ± 0.4 |
|
|
||||
| RUN5964 | MAT-POS-b3e365b9-1_1 |
|
EN300-6764836_3_2_1 |
|
−1.4 ± 0.3 |
|
|
||||
| RUN5800 | MAT-POS-b3e365b9-1_1 |
|
EN300-84785_2_2_1 |
|
−1.4 ± 0.3 |
|
|
||||
| RUN6277 | MAT-POS-b3e365b9-1_1 |
|
EN300-42195_1_2_1 |
|
−1.4 ± 0.3 |
|
|
||||
| RUN6972 | MAT-POS-b3e365b9-1_1 |
|
EN300-304662_3_1_2 |
|
−1.4 ± 0.3 |
|
|
||||
| RUN4330 | MAT-POS-b3e365b9-1_1 |
|
EN300-59478_1_1_1 |
|
−1.4 ± 0.3 |
|
|
||||
| RUN5474 | MAT-POS-b3e365b9-1_1 |
|
EN300-393334_1_1_1 |
|
−1.4 ± 0.4 |
|
|
||||
| RUN5401 | MAT-POS-b3e365b9-1_1 |
|
EN300-87528_3_1_1 |
|
−1.4 ± 0.3 |
|
|
||||
| RUN2968 | MAT-POS-b3e365b9-1_1 |
|
EN300-207959_3_1_1 |
|
−1.4 ± 0.3 |
|
|
||||
| RUN3691 | MAT-POS-b3e365b9-1_1 |
|
EN300-21303_3_1_1 |
|
−1.4 ± 0.2 |
|
|
||||
| RUN7515 | MAT-POS-b3e365b9-1_1 |
|
EN300-266023_2_1_1 |
|
−1.4 ± 0.3 |
|
|
||||
| RUN4101 | MAT-POS-b3e365b9-1_1 |
|
EN300-157776_1_1_1 |
|
−1.4 ± 0.3 |
|
|
||||
| RUN1364 | MAT-POS-b3e365b9-1_1 |
|
DAR-DIA-9e4459de-15_5 |
|
−1.4 ± 0.3 |
|
|
||||
| RUN1673 | MAT-POS-b3e365b9-1_1 |
|
EDG-MED-90036822-78_2 |
|
−1.4 ± 0.2 |
|
|
||||
| RUN5065 | MAT-POS-b3e365b9-1_1 |
|
EN300-332606_3_1_1 |
|
−1.4 ± 0.2 |
|
|
||||
| RUN6901 | MAT-POS-b3e365b9-1_1 |
|
EN300-657320_4_1_1 |
|
−1.4 ± 0.3 |
|
|
||||
| RUN4562 | MAT-POS-b3e365b9-1_1 |
|
EN300-20284_1_1_1 |
|
−1.4 ± 0.3 |
|
|
||||
| RUN7421 | MAT-POS-b3e365b9-1_1 |
|
EN300-7430165_1_1_1 |
|
−1.4 ± 0.3 |
|
|
||||
| RUN572 | MAT-POS-b3e365b9-1_1 |
|
JAG-UCB-706446eb-2_1 |
|
−1.4 ± 0.2 |
|
|
||||
| RUN2402 | MAT-POS-b3e365b9-1_1 |
|
EDJ-MED-fcba3f31-5_1 |
|
−1.4 ± 0.3 |
|
|
||||
| RUN3620 | MAT-POS-b3e365b9-1_1 |
|
EN300-39405_3_2_1 |
|
−1.4 ± 0.4 |
|
|
||||
| RUN6581 | MAT-POS-b3e365b9-1_1 |
|
EN300-182725_1_1_1 |
|
−1.4 ± 0.2 |
|
|
||||
| RUN6351 | MAT-POS-b3e365b9-1_1 |
|
EN300-19392_2_1_1 |
|
−1.4 ± 0.3 |
|
|
||||
| RUN583 | MAT-POS-b3e365b9-1_1 |
|
PET-UNK-29afea89-1_1 |
|
−1.4 ± 0.1 |
|
|
||||
| RUN3406 | MAT-POS-b3e365b9-1_1 |
|
EN300-214800_1_1_1 |
|
−1.4 ± 0.2 |
|
|
||||
| RUN5276 | MAT-POS-b3e365b9-1_1 |
|
EN300-119126_1_1_1 |
|
−1.4 ± 0.2 |
|
|
||||
| RUN3361 | MAT-POS-b3e365b9-1_1 |
|
EN300-310022_1_2_2 |
|
−1.4 ± 0.4 |
|
|
||||
| RUN3337 | MAT-POS-b3e365b9-1_1 |
|
EN300-301690_3_2_1 |
|
−1.4 ± 0.3 |
|
|
||||
| RUN1643 | MAT-POS-b3e365b9-1_1 |
|
EDG-MED-90036822-53_2 |
|
−1.4 ± 0.2 |
|
|
||||
| RUN2957 | MAT-POS-b3e365b9-1_1 |
|
EN300-14767_1_1_1 |
|
−1.4 ± 0.3 |
|
|
||||
| RUN5548 | MAT-POS-b3e365b9-1_1 |
|
EN300-11714_3_1_1 |
|
−1.4 ± 0.3 |
|
|
||||
| RUN3896 | MAT-POS-b3e365b9-1_1 |
|
EN300-2923949_1_1_1 |
|
−1.4 ± 0.3 |
|
|
||||
| RUN5887 | MAT-POS-b3e365b9-1_1 |
|
EN300-248888_3_1_1 |
|
−1.4 ± 0.3 |
|
|
||||
| RUN3197 | MAT-POS-b3e365b9-1_1 |
|
EN300-298552_1_3_1 |
|
−1.4 ± 0.3 |
|
|
||||