RUN | Initial microstate | Final microstate | ΔΔG / kcal M-1 | Work distribution | Convergence | ||||||
---|---|---|---|---|---|---|---|---|---|---|---|
RUN101 | MAT-POS-8a69d52e-7_1 | MAK-UNK-8be7dca9-10_1 | 3.2 ± 0.1 | ||||||||
RUN11984 | MAT-POS-8a69d52e-7_1 | EN300-41518_3_1 | 3.2 ± 0.3 | ||||||||
RUN8908 | MAT-POS-8a69d52e-7_1 | EN300-73703_1_1 | 3.2 ± 0.7 | ||||||||
RUN6231 | MAT-POS-8a69d52e-7_1 | EN300-1608240_2_1 | 3.2 ± 0.3 | ||||||||
RUN10500 | MAT-POS-8a69d52e-7_1 | EN300-239233_2_1 | 3.3 ± 0.3 | ||||||||
RUN14443 | MAT-POS-8a69d52e-7_1 | EN300-210110_4_1 | 3.3 ± 0.3 | ||||||||
RUN12855 | MAT-POS-8a69d52e-7_1 | EN300-69993_2_1 | 3.3 ± 0.4 | ||||||||
RUN132 | MAT-POS-8a69d52e-7_1 | MAK-UNK-8be7dca9-8_2 | 3.3 ± 0.2 | ||||||||
RUN11945 | MAT-POS-8a69d52e-7_1 | EN300-77408_2_4 | 3.3 ± 0.3 | ||||||||
RUN218 | MAT-POS-8a69d52e-7_1 | MAK-UNK-83e0a0b4-1_1 | 3.3 ± 0.5 | ||||||||
RUN11101 | MAT-POS-8a69d52e-7_1 | EN300-6479181_4_4 | 3.3 ± 0.3 | ||||||||
RUN12047 | MAT-POS-8a69d52e-7_1 | EN300-98214_2_1 | 3.3 ± 0.4 | ||||||||
RUN134 | MAT-POS-8a69d52e-7_1 | MAK-UNK-8be7dca9-9_2 | 3.3 ± 0.2 | ||||||||
RUN12195 | MAT-POS-8a69d52e-7_1 | EN300-134204_4_1 | 3.3 ± 0.4 | ||||||||
RUN10054 | MAT-POS-8a69d52e-7_1 | EN300-311920_4_1 | 3.4 ± 0.3 | ||||||||
RUN12643 | MAT-POS-8a69d52e-7_1 | EN300-1448674_4_1 | 3.4 ± 0.3 | ||||||||
RUN14518 | MAT-POS-8a69d52e-7_1 | EN300-208465_1_2 | 3.4 ± 0.4 | ||||||||
RUN13173 | MAT-POS-8a69d52e-7_1 | EN300-298550_2_1 | 3.4 ± 0.3 | ||||||||
RUN11774 | MAT-POS-8a69d52e-7_1 | EN300-69144_2_1 | 3.4 ± 0.3 | ||||||||
RUN3056 | MAT-POS-8a69d52e-7_1 | EN300-108422_2_1 | 3.4 ± 0.3 | ||||||||
RUN14929 | MAT-POS-8a69d52e-7_1 | EN300-6489476_2_1 | 3.4 ± 0.4 | ||||||||
RUN11975 | MAT-POS-8a69d52e-7_1 | EN300-7430501_4_2 | 3.4 ± 0.3 | ||||||||
RUN14253 | MAT-POS-8a69d52e-7_1 | EN300-1081929_2_4 | 3.4 ± 0.3 | ||||||||
RUN4784 | MAT-POS-8a69d52e-7_1 | EN300-41663_2_1 | 3.4 ± 0.3 | ||||||||
RUN12011 | MAT-POS-8a69d52e-7_1 | EN300-818709_2_1 | 3.4 ± 0.3 | ||||||||
RUN2850 | MAT-POS-8a69d52e-7_1 | EN300-7535791_2_1 | 3.5 ± 0.4 | ||||||||
RUN2425 | MAT-POS-8a69d52e-7_1 | EN300-761719_2_1 | 3.5 ± 0.4 | ||||||||
RUN14488 | MAT-POS-8a69d52e-7_1 | EN300-114540_1_1 | 3.5 ± 0.4 | ||||||||
RUN12850 | MAT-POS-8a69d52e-7_1 | EN300-1587825_1_1 | 3.5 ± 0.4 | ||||||||
RUN204 | MAT-POS-8a69d52e-7_1 | JOH-SUS-a69c159d-3_2 | 3.5 ± 0.2 | ||||||||
RUN9290 | MAT-POS-8a69d52e-7_1 | EN300-2666482_2_1 | 3.5 ± 0.2 | ||||||||
RUN10348 | MAT-POS-8a69d52e-7_1 | EN300-132613_4_1 | 3.5 ± 0.3 | ||||||||
RUN8751 | MAT-POS-8a69d52e-7_1 | EN300-60035_2_1 | 3.5 ± 0.3 | ||||||||
RUN14525 | MAT-POS-8a69d52e-7_1 | EN300-257058_2_1 | 3.5 ± 0.3 | ||||||||
RUN14551 | MAT-POS-8a69d52e-7_1 | EN300-248542_2_1 | 3.5 ± 0.3 | ||||||||
RUN13863 | MAT-POS-8a69d52e-7_1 | EN300-6733995_2_1 | 3.5 ± 0.4 | ||||||||
RUN1430 | MAT-POS-8a69d52e-7_1 | EN300-205518_2_1 | 3.6 ± 0.3 | ||||||||
RUN10310 | MAT-POS-8a69d52e-7_1 | EN300-159881_2_1 | 3.6 ± 0.4 | ||||||||
RUN7742 | MAT-POS-8a69d52e-7_1 | EN300-250593_4_1 | 3.6 ± 0.3 | ||||||||
RUN13950 | MAT-POS-8a69d52e-7_1 | EN300-33667_1_1 | 3.6 ± 0.6 | ||||||||
RUN12669 | MAT-POS-8a69d52e-7_1 | EN300-7537340_2_2 | 3.6 ± 0.3 | ||||||||
RUN3060 | MAT-POS-8a69d52e-7_1 | EN300-108422_2_1 | 3.7 ± 0.4 | ||||||||
RUN8767 | MAT-POS-8a69d52e-7_1 | EN300-227021_2_1 | 3.7 ± 0.3 | ||||||||
RUN14863 | MAT-POS-8a69d52e-7_1 | EN300-1425963_2_3 | 3.7 ± 0.3 | ||||||||
RUN211 | MAT-POS-8a69d52e-7_1 | MAK-UNK-83e0a0b4-4_1 | 3.7 ± 0.4 | ||||||||
RUN10165 | MAT-POS-8a69d52e-7_1 | EN300-7444122_1_4 | 3.7 ± 0.5 | ||||||||
RUN1342 | MAT-POS-8a69d52e-7_1 | EN300-52212_2_3 | 3.7 ± 0.3 | ||||||||
RUN3733 | MAT-POS-8a69d52e-7_1 | EN300-199149_1_1 | 3.7 ± 0.4 | ||||||||
RUN11700 | MAT-POS-8a69d52e-7_1 | EN300-107493_4_1 | 3.8 ± 0.2 | ||||||||
RUN4816 | MAT-POS-8a69d52e-7_1 | EN300-318110_2_1 | 3.8 ± 0.3 | ||||||||
RUN13971 | MAT-POS-8a69d52e-7_1 | EN300-213215_2_8 | 3.8 ± 0.4 | ||||||||
RUN12443 | MAT-POS-8a69d52e-7_1 | EN300-42007_2_1 | 3.8 ± 0.5 | ||||||||
RUN12329 | MAT-POS-8a69d52e-7_1 | EN300-153245_2_1 | 3.8 ± 0.3 | ||||||||
RUN13811 | MAT-POS-8a69d52e-7_1 | EN300-325737_4_1 | 3.8 ± 0.3 | ||||||||
RUN12399 | MAT-POS-8a69d52e-7_1 | EN300-1233032_2_2 | 3.8 ± 0.4 |