| RUN | Initial microstate | Final microstate | ΔΔG / kcal M-1 | Work distribution | Convergence | ||||||
|---|---|---|---|---|---|---|---|---|---|---|---|
| RUN7664 | MAT-POS-b3e365b9-1_1 |
|
EN300-746187_2_1_1 |
|
−0.4 ± 0.3 |
|
|
||||
| RUN1420 | MAT-POS-b3e365b9-1_1 |
|
ED_-GRI-5b13fbe2-47_2 |
|
−0.4 ± 0.2 |
|
|
||||
| RUN3249 | MAT-POS-b3e365b9-1_1 |
|
EN300-77778_1_2_1 |
|
−0.4 ± 0.3 |
|
|
||||
| RUN7818 | MAT-POS-b3e365b9-1_1 |
|
EN300-307333_1_1_1 |
|
−0.4 ± 0.2 |
|
|
||||
| RUN1825 | MAT-POS-b3e365b9-1_1 |
|
RAL-THA-2d450e86-18_1 |
|
−0.4 ± 0.3 |
|
|
||||
| RUN6128 | MAT-POS-b3e365b9-1_1 |
|
EN300-91905_4_1_1 |
|
−0.4 ± 0.4 |
|
|
||||
| RUN497 | MAT-POS-b3e365b9-1_1 |
|
ADA-UCB-dc2b944c-10_1 |
|
−0.38 ± 0.09 |
|
|
||||
| RUN1415 | MAT-POS-b3e365b9-1_1 |
|
ED_-GRI-5b13fbe2-39_1 |
|
−0.4 ± 0.3 |
|
|
||||
| RUN2597 | MAT-POS-b3e365b9-1_1 |
|
ALF-EVA-0b412456-7_1 |
|
−0.4 ± 0.4 |
|
|
||||
| RUN6146 | MAT-POS-b3e365b9-1_1 |
|
EN300-181178_1_1_1 |
|
−0.4 ± 0.3 |
|
|
||||
| RUN5428 | MAT-POS-b3e365b9-1_1 |
|
EN300-7439043_2_1_1 |
|
−0.4 ± 0.2 |
|
|
||||
| RUN6084 | MAT-POS-b3e365b9-1_1 |
|
EN300-6762327_2_2_1 |
|
−0.4 ± 0.3 |
|
|
||||
| RUN4582 | MAT-POS-b3e365b9-1_1 |
|
EN300-132613_1_1_1 |
|
−0.4 ± 0.3 |
|
|
||||
| RUN4533 | MAT-POS-b3e365b9-1_1 |
|
EN300-117685_2_1_1 |
|
−0.4 ± 0.3 |
|
|
||||
| RUN4549 | MAT-POS-b3e365b9-1_1 |
|
EN300-60314_1_1_1 |
|
−0.4 ± 0.3 |
|
|
||||
| RUN305 | MAT-POS-b3e365b9-1_1 |
|
EDJ-MED-50011917-1_1 |
|
−0.4 ± 0.4 |
|
|
||||
| RUN7252 | MAT-POS-b3e365b9-1_1 |
|
EN300-2853791_1_1_1 |
|
−0.4 ± 0.3 |
|
|
||||
| RUN4935 | MAT-POS-b3e365b9-1_1 |
|
EN300-100916_3_1_1 |
|
−0.4 ± 0.3 |
|
|
||||
| RUN2344 | MAT-POS-b3e365b9-1_1 |
|
ALP-UNI-3496895b-12_1 |
|
−0.4 ± 0.3 |
|
|
||||
| RUN1135 | MAT-POS-b3e365b9-1_1 |
|
BEN-DND-c852c98b-6_1 |
|
−0.38 ± 0.06 |
|
|
||||
| RUN6333 | MAT-POS-b3e365b9-1_1 |
|
EN300-67573_2_1_1 |
|
−0.4 ± 0.3 |
|
|
||||
| RUN2559 | MAT-POS-b3e365b9-1_1 |
|
ALF-EVA-0b412456-7_2 |
|
−0.4 ± 0.4 |
|
|
||||
| RUN4505 | MAT-POS-b3e365b9-1_1 |
|
EN300-7353672_1_3_1 |
|
−0.4 ± 0.3 |
|
|
||||
| RUN7658 | MAT-POS-b3e365b9-1_1 |
|
EN300-192809_3_2_1 |
|
−0.4 ± 0.5 |
|
|
||||
| RUN7230 | MAT-POS-b3e365b9-1_1 |
|
EN300-120920_2_2_1 |
|
−0.4 ± 0.2 |
|
|
||||
| RUN5296 | MAT-POS-b3e365b9-1_1 |
|
EN300-13668_2_1_1 |
|
−0.4 ± 0.3 |
|
|
||||
| RUN5212 | MAT-POS-b3e365b9-1_1 |
|
EN300-220527_3_1_1 |
|
−0.4 ± 0.3 |
|
|
||||
| RUN7574 | MAT-POS-b3e365b9-1_1 |
|
EN300-112872_3_1_1 |
|
−0.4 ± 0.4 |
|
|
||||
| RUN3397 | MAT-POS-b3e365b9-1_1 |
|
EN300-53591_1_1_1 |
|
−0.4 ± 0.3 |
|
|
||||
| RUN1429 | MAT-POS-b3e365b9-1_1 |
|
ED_-GRI-5b13fbe2-17_1 |
|
−0.4 ± 0.4 |
|
|
||||
| RUN5363 | MAT-POS-b3e365b9-1_1 |
|
EN300-218288_1_1_1 |
|
−0.4 ± 0.2 |
|
|
||||
| RUN6141 | MAT-POS-b3e365b9-1_1 |
|
EN300-52768_3_1_1 |
|
−0.4 ± 0.4 |
|
|
||||
| RUN2425 | MAT-POS-b3e365b9-1_1 |
|
EDJ-MED-d203f206-10_1 |
|
−0.4 ± 0.4 |
|
|
||||
| RUN6755 | MAT-POS-b3e365b9-1_1 |
|
EN300-249421_2_2_1 |
|
−0.4 ± 0.3 |
|
|
||||
| RUN3000 | MAT-POS-b3e365b9-1_1 |
|
EN300-19762_1_1_1 |
|
−0.4 ± 0.4 |
|
|
||||
| RUN7173 | MAT-POS-b3e365b9-1_1 |
|
EN300-14458_1_2_1 |
|
−0.4 ± 0.2 |
|
|
||||
| RUN3251 | MAT-POS-b3e365b9-1_1 |
|
EN300-1653482_1_2_2 |
|
−0.4 ± 0.4 |
|
|
||||
| RUN7083 | MAT-POS-b3e365b9-1_1 |
|
EN300-7442191_1_2_1 |
|
−0.4 ± 0.4 |
|
|
||||
| RUN7449 | MAT-POS-b3e365b9-1_1 |
|
EN300-53591_2_1_1 |
|
−0.4 ± 0.3 |
|
|
||||
| RUN1586 | MAT-POS-b3e365b9-1_1 |
|
EDG-MED-90036822-63_1 |
|
−0.4 ± 0.2 |
|
|
||||
| RUN1386 | MAT-POS-b3e365b9-1_1 |
|
ED_-GRI-5b13fbe2-4_1 |
|
−0.4 ± 0.3 |
|
|
||||
| RUN3538 | MAT-POS-b3e365b9-1_1 |
|
EN300-399606_1_1_1 |
|
−0.4 ± 0.2 |
|
|
||||
| RUN7795 | MAT-POS-b3e365b9-1_1 |
|
EN300-1600517_1_2_1 |
|
−0.4 ± 0.3 |
|
|
||||
| RUN5467 | MAT-POS-b3e365b9-1_1 |
|
EN300-143449_4_1_1 |
|
−0.4 ± 0.3 |
|
|
||||
| RUN5488 | MAT-POS-b3e365b9-1_1 |
|
EN300-86732_1_1_1 |
|
−0.4 ± 0.3 |
|
|
||||
| RUN6304 | MAT-POS-b3e365b9-1_1 |
|
EN300-315836_4_1_1 |
|
−0.4 ± 0.3 |
|
|
||||
| RUN6515 | MAT-POS-b3e365b9-1_1 |
|
DAR-DIA-0d514e7d-1_1_1 |
|
−0.4 ± 0.1 |
|
|
||||
| RUN6460 | MAT-POS-b3e365b9-1_1 |
|
EN300-1709315_3_1_1 |
|
−0.4 ± 0.3 |
|
|
||||
| RUN7639 | MAT-POS-b3e365b9-1_1 |
|
EN300-365650_1_1_1 |
|
−0.4 ± 0.2 |
|
|
||||
| RUN4174 | MAT-POS-b3e365b9-1_1 |
|
EN300-7354033_1_1_1 |
|
−0.4 ± 0.2 |
|
|
||||
| RUN6718 | MAT-POS-b3e365b9-1_1 |
|
EN300-53656_1_2_1 |
|
−0.4 ± 0.3 |
|
|
||||
| RUN6895 | MAT-POS-b3e365b9-1_1 |
|
EN300-233951_1_2_1 |
|
−0.4 ± 0.3 |
|
|
||||
| RUN499 | MAT-POS-b3e365b9-1_1 |
|
MIC-UNK-bcd487e9-7_1 |
|
−0.4 ± 0.4 |
|
|
||||
| RUN6602 | MAT-POS-b3e365b9-1_1 |
|
EN300-67791_1_1_1 |
|
−0.4 ± 0.4 |
|
|
||||
| RUN7647 | MAT-POS-b3e365b9-1_1 |
|
EN300-217499_1_1_1 |
|
−0.4 ± 0.2 |
|
|
||||
| RUN1570 | MAT-POS-b3e365b9-1_1 |
|
EDG-MED-90036822-12_2 |
|
−0.4 ± 0.3 |
|
|
||||
| RUN7053 | MAT-POS-b3e365b9-1_1 |
|
EN300-151411_1_1_1 |
|
−0.4 ± 0.3 |
|
|
||||
| RUN1560 | MAT-POS-b3e365b9-1_1 |
|
EDG-MED-90036822-20_2 |
|
−0.4 ± 0.2 |
|
|
||||
| RUN5691 | MAT-POS-b3e365b9-1_1 |
|
EN300-109920_1_3_1 |
|
−0.4 ± 0.6 |
|
|
||||
| RUN6312 | MAT-POS-b3e365b9-1_1 |
|
EN300-7351945_1_2_1 |
|
−0.4 ± 0.2 |
|
|
||||
| RUN1104 | MAT-POS-b3e365b9-1_1 |
|
BEN-DND-c852c98b-5_1 |
|
−0.37 ± 0.08 |
|
|
||||
| RUN143 | MAT-POS-b3e365b9-1_1 |
|
MIC-UNK-c66144cb-2_1 |
|
−0.4 ± 0.3 |
|
|
||||
| RUN7001 | MAT-POS-b3e365b9-1_1 |
|
EN300-304662_3_1_3 |
|
−0.4 ± 0.3 |
|
|
||||
| RUN3666 | MAT-POS-b3e365b9-1_1 |
|
EN300-98018_1_1_1 |
|
−0.4 ± 0.4 |
|
|
||||
| RUN4240 | MAT-POS-b3e365b9-1_1 |
|
EN300-152705_3_1_1 |
|
−0.4 ± 0.3 |
|
|
||||
| RUN701 | MAT-POS-b3e365b9-1_1 |
|
MIC-UNK-5a93dd5f-12_3 |
|
−0.4 ± 0.4 |
|
|
||||
| RUN6411 | MAT-POS-b3e365b9-1_1 |
|
EN300-91609_1_1_1 |
|
−0.4 ± 0.3 |
|
|
||||
| RUN5298 | MAT-POS-b3e365b9-1_1 |
|
EN300-14767_2_2_1 |
|
−0.4 ± 0.3 |
|
|
||||
| RUN4357 | MAT-POS-b3e365b9-1_1 |
|
EN300-254840_1_1_1 |
|
−0.4 ± 0.4 |
|
|
||||
| RUN4392 | MAT-POS-b3e365b9-1_1 |
|
EN300-2977549_4_1_1 |
|
−0.4 ± 0.3 |
|
|
||||
| RUN1431 | MAT-POS-b3e365b9-1_1 |
|
ED_-GRI-5b13fbe2-20_1 |
|
−0.4 ± 0.4 |
|
|
||||
| RUN429 | MAT-POS-b3e365b9-1_1 |
|
MAK-UNK-8be7dca9-2_1 |
|
−0.36 ± 0.07 |
|
|
||||
| RUN7775 | MAT-POS-b3e365b9-1_1 |
|
EN300-2855057_3_1_1 |
|
−0.4 ± 0.5 |
|
|
||||
| RUN5005 | MAT-POS-b3e365b9-1_1 |
|
EN300-257405_1_2_1 |
|
−0.4 ± 0.3 |
|
|
||||
| RUN6823 | MAT-POS-b3e365b9-1_1 |
|
EN300-103187_4_1_1 |
|
−0.4 ± 0.3 |
|
|
||||
| RUN5811 | MAT-POS-b3e365b9-1_1 |
|
EN300-303908_2_1_1 |
|
−0.4 ± 0.3 |
|
|
||||
| RUN4831 | MAT-POS-b3e365b9-1_1 |
|
EN300-1717166_3_2_1 |
|
−0.4 ± 0.3 |
|
|
||||
| RUN1410 | MAT-POS-b3e365b9-1_1 |
|
ED_-GRI-5b13fbe2-30_1 |
|
−0.4 ± 0.6 |
|
|
||||
| RUN6217 | MAT-POS-b3e365b9-1_1 |
|
DAR-DIA-23e5a6a0-1_1_1 |
|
−0.4 ± 0.4 |
|
|
||||
| RUN3997 | MAT-POS-b3e365b9-1_1 |
|
EN300-98648_2_1_1 |
|
−0.4 ± 0.2 |
|
|
||||
| RUN6467 | MAT-POS-b3e365b9-1_1 |
|
EN300-6489145_1_1_1 |
|
−0.3 ± 0.3 |
|
|
||||
| RUN2951 | MAT-POS-b3e365b9-1_1 |
|
EN300-7445396_1_2_1 |
|
−0.3 ± 0.4 |
|
|
||||
| RUN2743 | MAT-POS-b3e365b9-1_1 |
|
EN300-76541_1_3_1 |
|
−0.3 ± 0.5 |
|
|
||||
| RUN5376 | MAT-POS-b3e365b9-1_1 |
|
EN300-142333_1_1_1 |
|
−0.3 ± 0.3 |
|
|
||||
| RUN5449 | MAT-POS-b3e365b9-1_1 |
|
EN300-1709295_1_1_1 |
|
−0.3 ± 0.3 |
|
|
||||
| RUN5772 | MAT-POS-b3e365b9-1_1 |
|
EN300-302290_3_1_1 |
|
−0.3 ± 0.3 |
|
|
||||
| RUN5395 | MAT-POS-b3e365b9-1_1 |
|
ADA-UCB-dc2b944c-16_1_1 |
|
−0.35 ± 0.10 |
|
|
||||
| RUN2380 | MAT-POS-b3e365b9-1_1 |
|
EDJ-MED-d203f206-1_1 |
|
−0.3 ± 0.2 |
|
|
||||
| RUN1287 | MAT-POS-b3e365b9-1_1 |
|
BEN-DND-a7517465-3_1 |
|
−0.3 ± 0.2 |
|
|
||||
| RUN3450 | MAT-POS-b3e365b9-1_1 |
|
EN300-87536_2_1_1 |
|
−0.3 ± 0.3 |
|
|
||||
| RUN7071 | MAT-POS-b3e365b9-1_1 |
|
EN300-118760_2_2_1 |
|
−0.3 ± 0.3 |
|
|
||||
| RUN6182 | MAT-POS-b3e365b9-1_1 |
|
EN300-14949_1_1_1 |
|
−0.3 ± 0.3 |
|
|
||||
| RUN5796 | MAT-POS-b3e365b9-1_1 |
|
EN300-59487_1_2_1 |
|
−0.3 ± 0.3 |
|
|
||||
| RUN1461 | MAT-POS-b3e365b9-1_1 |
|
ED_-GRI-5b13fbe2-46_1 |
|
−0.3 ± 0.5 |
|
|
||||
| RUN4037 | MAT-POS-b3e365b9-1_1 |
|
EN300-90142_3_4_1 |
|
−0.3 ± 0.3 |
|
|
||||
| RUN6306 | MAT-POS-b3e365b9-1_1 |
|
EN300-173006_4_1_1 |
|
−0.3 ± 0.4 |
|
|
||||
| RUN779 | MAT-POS-b3e365b9-1_1 |
|
DAR-DIA-0d514e7d-33_4 |
|
−0.3 ± 0.2 |
|
|
||||
| RUN4256 | MAT-POS-b3e365b9-1_1 |
|
EN300-175487_1_1_1 |
|
−0.3 ± 0.4 |
|
|
||||
| RUN4940 | MAT-POS-b3e365b9-1_1 |
|
EN300-225165_1_1_1 |
|
−0.3 ± 0.3 |
|
|
||||
| RUN2191 | MAT-POS-b3e365b9-1_1 |
|
EDG-MED-5d232de5-1_1 |
|
−0.34 ± 0.04 |
|
|
||||