| RUN | Initial microstate | Final microstate | ΔΔG / kcal M-1 | Work distribution | Convergence | ||||||
|---|---|---|---|---|---|---|---|---|---|---|---|
| RUN9520 | MAT-POS-8a69d52e-7_1 |
|
EN300-254121_3_2 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN2707 | MAT-POS-8a69d52e-7_1 |
|
EN300-6486576_2_1 |
|
−0.6 ± 0.2 |
|
|
||||
| RUN5289 | MAT-POS-8a69d52e-7_1 |
|
EN300-212795_1_1 |
|
−0.6 ± 0.2 |
|
|
||||
| RUN42 | MAT-POS-8a69d52e-7_1 |
|
ALP-POS-d3acb8cc-1_1 |
|
−0.58 ± 0.06 |
|
|
||||
| RUN15220 | MAT-POS-8a69d52e-7_1 |
|
EN300-1273016_3_2 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN1009 | MAT-POS-8a69d52e-7_1 |
|
EN300-6486576_3_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN5012 | MAT-POS-8a69d52e-7_1 |
|
EN300-75030_2_2 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN12418 | MAT-POS-8a69d52e-7_1 |
|
EN300-77438_1_2 |
|
−0.6 ± 0.2 |
|
|
||||
| RUN7263 | MAT-POS-8a69d52e-7_1 |
|
EN300-60514_3_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN12096 | MAT-POS-8a69d52e-7_1 |
|
EN300-1698571_1_1 |
|
−0.6 ± 0.2 |
|
|
||||
| RUN5846 | MAT-POS-8a69d52e-7_1 |
|
EN300-1654606_1_1 |
|
−0.6 ± 0.2 |
|
|
||||
| RUN652 | MAT-POS-8a69d52e-7_1 |
|
EN300-1448603_2_1 |
|
−0.6 ± 0.2 |
|
|
||||
| RUN15266 | MAT-POS-8a69d52e-7_1 |
|
EN300-22245_3_1 |
|
−0.6 ± 0.2 |
|
|
||||
| RUN8059 | MAT-POS-8a69d52e-7_1 |
|
EN300-105482_1_1 |
|
−0.6 ± 0.2 |
|
|
||||
| RUN11918 | MAT-POS-8a69d52e-7_1 |
|
EN300-182084_3_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN43 | MAT-POS-8a69d52e-7_1 |
|
ALP-POS-d3acb8cc-1_1 |
|
−0.57 ± 0.06 |
|
|
||||
| RUN197 | MAT-POS-8a69d52e-7_1 |
|
MAK-UNK-83e0a0b4-2_1 |
|
−0.6 ± 0.4 |
|
|
||||
| RUN14429 | MAT-POS-8a69d52e-7_1 |
|
EN300-91609_2_2 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN9030 | MAT-POS-8a69d52e-7_1 |
|
EN300-147397_2_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN112 | MAT-POS-8a69d52e-7_1 |
|
ADA-UCB-dc2b944c-13_1 |
|
−0.6 ± 0.1 |
|
|
||||
| RUN10035 | MAT-POS-8a69d52e-7_1 |
|
EN300-255498_1_1 |
|
−0.6 ± 0.2 |
|
|
||||
| RUN3013 | MAT-POS-8a69d52e-7_1 |
|
EN300-260760_1_1 |
|
−0.6 ± 0.2 |
|
|
||||
| RUN7458 | MAT-POS-8a69d52e-7_1 |
|
EN300-91609_2_1 |
|
−0.6 ± 0.2 |
|
|
||||
| RUN633 | MAT-POS-8a69d52e-7_1 |
|
EN300-383906_3_1 |
|
−0.6 ± 0.2 |
|
|
||||
| RUN12698 | MAT-POS-8a69d52e-7_1 |
|
EN300-1719075_1_2 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN15174 | MAT-POS-8a69d52e-7_1 |
|
EN300-1588617_3_1 |
|
−0.6 ± 0.2 |
|
|
||||
| RUN14344 | MAT-POS-8a69d52e-7_1 |
|
EN300-42154_3_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN12622 | MAT-POS-8a69d52e-7_1 |
|
EN300-121078_1_1 |
|
−0.6 ± 0.2 |
|
|
||||
| RUN6145 | MAT-POS-8a69d52e-7_1 |
|
EN300-305294_1_8 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN7004 | MAT-POS-8a69d52e-7_1 |
|
EN300-16248_1_1 |
|
−0.6 ± 0.2 |
|
|
||||
| RUN2606 | MAT-POS-8a69d52e-7_1 |
|
EN300-2007627_2_2 |
|
−0.6 ± 0.4 |
|
|
||||
| RUN3419 | MAT-POS-8a69d52e-7_1 |
|
EN300-365017_2_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN7237 | MAT-POS-8a69d52e-7_1 |
|
EN300-51350_2_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN13568 | MAT-POS-8a69d52e-7_1 |
|
EN300-6489476_1_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN5369 | MAT-POS-8a69d52e-7_1 |
|
EN300-7434114_1_2 |
|
−0.6 ± 0.2 |
|
|
||||
| RUN4241 | MAT-POS-8a69d52e-7_1 |
|
EN300-6474647_1_2 |
|
−0.6 ± 0.2 |
|
|
||||
| RUN3789 | MAT-POS-8a69d52e-7_1 |
|
EN300-332714_1_4 |
|
−0.6 ± 0.4 |
|
|
||||
| RUN14618 | MAT-POS-8a69d52e-7_1 |
|
EN300-36850_3_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN8017 | MAT-POS-8a69d52e-7_1 |
|
EN300-139268_2_1 |
|
−0.6 ± 0.2 |
|
|
||||
| RUN5435 | MAT-POS-8a69d52e-7_1 |
|
EN300-219496_2_3 |
|
−0.6 ± 0.6 |
|
|
||||
| RUN6691 | MAT-POS-8a69d52e-7_1 |
|
EN300-226776_1_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN5426 | MAT-POS-8a69d52e-7_1 |
|
EN300-36622_1_1 |
|
−0.6 ± 0.2 |
|
|
||||
| RUN15422 | MAT-POS-8a69d52e-7_1 |
|
EN300-111006_3_1 |
|
−0.6 ± 0.2 |
|
|
||||
| RUN540 | MAT-POS-8a69d52e-7_1 |
|
EN300-6504697_2_2 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN11954 | MAT-POS-8a69d52e-7_1 |
|
EN300-321053_1_4 |
|
−0.6 ± 0.2 |
|
|
||||
| RUN6072 | MAT-POS-8a69d52e-7_1 |
|
EN300-80481_2_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN7188 | MAT-POS-8a69d52e-7_1 |
|
EN300-6792206_1_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN15039 | MAT-POS-8a69d52e-7_1 |
|
EN300-79180_3_1 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN2739 | MAT-POS-8a69d52e-7_1 |
|
EN300-107267_1_1 |
|
−0.6 ± 0.2 |
|
|
||||
| RUN11650 | MAT-POS-8a69d52e-7_1 |
|
EN300-370753_4_1 |
|
−0.6 ± 0.2 |
|
|
||||
| RUN1661 | MAT-POS-8a69d52e-7_1 |
|
EN300-1699871_1_2 |
|
−0.6 ± 0.3 |
|
|
||||
| RUN4690 | MAT-POS-8a69d52e-7_1 |
|
EN300-52383_1_1 |
|
−0.5 ± 0.3 |
|
|
||||
| RUN6699 | MAT-POS-8a69d52e-7_1 |
|
EN300-129424_1_4 |
|
−0.5 ± 0.2 |
|
|
||||
| RUN12444 | MAT-POS-8a69d52e-7_1 |
|
EN300-70092_1_1 |
|
−0.5 ± 0.2 |
|
|
||||
| RUN6459 | MAT-POS-8a69d52e-7_1 |
|
EN300-221122_1_1 |
|
−0.5 ± 0.3 |
|
|
||||
| RUN13958 | MAT-POS-8a69d52e-7_1 |
|
EN300-129384_1_1 |
|
−0.5 ± 0.2 |
|
|
||||
| RUN679 | MAT-POS-8a69d52e-7_1 |
|
EN300-47046_1_1 |
|
−0.5 ± 0.3 |
|
|
||||
| RUN11238 | MAT-POS-8a69d52e-7_1 |
|
EN300-60033_3_2 |
|
−0.5 ± 0.3 |
|
|
||||
| RUN11295 | MAT-POS-8a69d52e-7_1 |
|
EN300-36158_3_1 |
|
−0.5 ± 0.2 |
|
|
||||
| RUN7765 | MAT-POS-8a69d52e-7_1 |
|
EN300-6482296_2_7 |
|
−0.5 ± 0.3 |
|
|
||||
| RUN6499 | MAT-POS-8a69d52e-7_1 |
|
EN300-304381_1_1 |
|
−0.5 ± 0.2 |
|
|
||||
| RUN6336 | MAT-POS-8a69d52e-7_1 |
|
EN300-7370063_1_1 |
|
−0.5 ± 0.2 |
|
|
||||
| RUN9332 | MAT-POS-8a69d52e-7_1 |
|
EN300-98429_1_1 |
|
−0.5 ± 0.2 |
|
|
||||
| RUN5785 | MAT-POS-8a69d52e-7_1 |
|
EN300-6499164_1_2 |
|
−0.5 ± 0.2 |
|
|
||||
| RUN10007 | MAT-POS-8a69d52e-7_1 |
|
EN300-57949_1_1 |
|
−0.5 ± 0.3 |
|
|
||||
| RUN10185 | MAT-POS-8a69d52e-7_1 |
|
EN300-1179690_1_1 |
|
−0.5 ± 0.3 |
|
|
||||
| RUN13606 | MAT-POS-8a69d52e-7_1 |
|
EN300-1087187_1_2 |
|
−0.5 ± 0.2 |
|
|
||||
| RUN12950 | MAT-POS-8a69d52e-7_1 |
|
EN300-7355477_1_5 |
|
−0.5 ± 0.3 |
|
|
||||
| RUN8483 | MAT-POS-8a69d52e-7_1 |
|
EN300-366540_1_1 |
|
−0.5 ± 0.2 |
|
|
||||
| RUN1827 | MAT-POS-8a69d52e-7_1 |
|
EN300-6745581_2_1 |
|
−0.5 ± 0.3 |
|
|
||||
| RUN4826 | MAT-POS-8a69d52e-7_1 |
|
EN300-113234_1_2 |
|
−0.5 ± 0.2 |
|
|
||||
| RUN13947 | MAT-POS-8a69d52e-7_1 |
|
EN300-305294_2_7 |
|
−0.5 ± 0.2 |
|
|
||||
| RUN621 | MAT-POS-8a69d52e-7_1 |
|
EN300-6238494_4_2 |
|
−0.5 ± 0.2 |
|
|
||||
| RUN11383 | MAT-POS-8a69d52e-7_1 |
|
EN300-140582_3_4 |
|
−0.5 ± 0.3 |
|
|
||||
| RUN9172 | MAT-POS-8a69d52e-7_1 |
|
EN300-250593_3_2 |
|
−0.5 ± 0.3 |
|
|
||||
| RUN10755 | MAT-POS-8a69d52e-7_1 |
|
EN300-344753_1_1 |
|
−0.5 ± 0.4 |
|
|
||||
| RUN1867 | MAT-POS-8a69d52e-7_1 |
|
EN300-154944_2_1 |
|
−0.5 ± 0.3 |
|
|
||||
| RUN7479 | MAT-POS-8a69d52e-7_1 |
|
EN300-370951_1_1 |
|
−0.5 ± 0.2 |
|
|
||||
| RUN2806 | MAT-POS-8a69d52e-7_1 |
|
EN300-1072972_3_1 |
|
−0.5 ± 0.3 |
|
|
||||
| RUN1777 | MAT-POS-8a69d52e-7_1 |
|
EN300-72896_1_1 |
|
−0.5 ± 0.2 |
|
|
||||
| RUN243 | MAT-POS-8a69d52e-7_1 |
|
EN300-101291_1_1 |
|
−0.5 ± 0.3 |
|
|
||||
| RUN3949 | MAT-POS-8a69d52e-7_1 |
|
EN300-134855_3_1 |
|
−0.5 ± 0.3 |
|
|
||||
| RUN8235 | MAT-POS-8a69d52e-7_1 |
|
EN300-65352_1_1 |
|
−0.5 ± 0.4 |
|
|
||||
| RUN1018 | MAT-POS-8a69d52e-7_1 |
|
EN300-749499_1_2 |
|
−0.5 ± 0.3 |
|
|
||||
| RUN8030 | MAT-POS-8a69d52e-7_1 |
|
EN300-266299_2_1 |
|
−0.5 ± 0.3 |
|
|
||||
| RUN5549 | MAT-POS-8a69d52e-7_1 |
|
EN300-66126_1_1 |
|
−0.5 ± 0.2 |
|
|
||||