RUN | Initial microstate | Final microstate | ΔΔG / kcal M-1 | Work distribution | Convergence | ||||||
---|---|---|---|---|---|---|---|---|---|---|---|
RUN471 | MAT-POS-b3e365b9-1_1 |
|
EN300-7433071_1_2 |
|
−0.5 ± 0.5 |
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RUN3902 | MAT-POS-b3e365b9-1_1 |
|
EN300-07879_2_1 |
|
−0.5 ± 0.2 |
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RUN3290 | MAT-POS-b3e365b9-1_1 |
|
EN300-182725_1_4 |
|
−0.5 ± 0.3 |
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RUN6182 | MAT-POS-b3e365b9-1_1 |
|
EN300-207873_3_1 |
|
−0.5 ± 0.3 |
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RUN942 | MAT-POS-b3e365b9-1_1 |
|
EN300-7003350_2_1 |
|
−0.5 ± 0.2 |
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RUN3552 | MAT-POS-b3e365b9-1_1 |
|
EN300-396146_1_1 |
|
−0.5 ± 0.3 |
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||||
RUN3020 | MAT-POS-b3e365b9-1_1 |
|
EN300-341337_3_4 |
|
−0.5 ± 0.3 |
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||||
RUN958 | MAT-POS-b3e365b9-1_1 |
|
EN300-7003350_2_1 |
|
−0.5 ± 0.2 |
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||||
RUN4154 | MAT-POS-b3e365b9-1_1 |
|
EN300-1073320_2_1 |
|
−0.5 ± 0.3 |
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||||
RUN531 | MAT-POS-b3e365b9-1_1 |
|
EN300-79588_4_1 |
|
−0.5 ± 0.3 |
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||||
RUN7050 | MAT-POS-b3e365b9-1_1 |
|
EN300-58433_1_1 |
|
−0.5 ± 0.4 |
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||||
RUN2596 | MAT-POS-b3e365b9-1_1 |
|
EN300-118647_1_1 |
|
−0.5 ± 0.2 |
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RUN8951 | MAT-POS-b3e365b9-1_1 |
|
EN300-685492_1_1 |
|
−0.5 ± 0.3 |
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||||
RUN666 | MAT-POS-b3e365b9-1_1 |
|
EN300-46832_2_1 |
|
−0.5 ± 0.3 |
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||||
RUN7004 | MAT-POS-b3e365b9-1_1 |
|
EN300-657222_1_1 |
|
−0.5 ± 0.3 |
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||||
RUN8301 | MAT-POS-b3e365b9-1_1 |
|
EN300-6974806_4_1 |
|
−0.5 ± 0.4 |
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||||
RUN11179 | MAT-POS-b3e365b9-1_1 |
|
EN300-1091496_2_1 |
|
−0.5 ± 0.3 |
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||||
RUN11140 | MAT-POS-b3e365b9-1_1 |
|
EN300-92790_3_1 |
|
−0.5 ± 0.3 |
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||||
RUN4681 | MAT-POS-b3e365b9-1_1 |
|
EN300-1588613_1_4 |
|
−0.5 ± 0.4 |
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||||
RUN9605 | MAT-POS-b3e365b9-1_1 |
|
EN300-54304_4_1 |
|
−0.5 ± 0.4 |
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||||
RUN3266 | MAT-POS-b3e365b9-1_1 |
|
EN300-104746_1_2 |
|
−0.5 ± 0.3 |
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||||
RUN8164 | MAT-POS-b3e365b9-1_1 |
|
EN300-6493972_3_1 |
|
−0.5 ± 0.3 |
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||||
RUN4843 | MAT-POS-b3e365b9-1_1 |
|
EN300-113633_1_1 |
|
−0.5 ± 0.2 |
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||||
RUN6758 | MAT-POS-b3e365b9-1_1 |
|
EN300-250416_2_1 |
|
−0.5 ± 0.3 |
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||||
RUN3178 | MAT-POS-b3e365b9-1_1 |
|
EN300-04073_1_1 |
|
−0.5 ± 0.2 |
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||||
RUN1661 | MAT-POS-b3e365b9-1_1 |
|
EN300-28113_2_2 |
|
−0.5 ± 0.3 |
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||||
RUN7317 | MAT-POS-b3e365b9-1_1 |
|
EN300-341011_2_1 |
|
−0.5 ± 0.3 |
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||||
RUN5962 | MAT-POS-b3e365b9-1_1 |
|
EN300-98429_1_1 |
|
−0.5 ± 0.3 |
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||||
RUN454 | MAT-POS-b3e365b9-1_1 |
|
EN300-223491_2_1 |
|
−0.5 ± 0.3 |
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||||
RUN11276 | MAT-POS-b3e365b9-1_1 |
|
EN300-43047_3_2 |
|
−0.5 ± 0.3 |
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||||
RUN324 | MAT-POS-b3e365b9-1_1 |
|
EN300-87334_4_1 |
|
−0.5 ± 0.3 |
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||||
RUN10135 | MAT-POS-b3e365b9-1_1 |
|
EN300-6498351_3_1 |
|
−0.5 ± 0.4 |
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||||
RUN337 | MAT-POS-b3e365b9-1_1 |
|
EN300-1911992_3_2 |
|
−0.5 ± 0.3 |
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||||
RUN3052 | MAT-POS-b3e365b9-1_1 |
|
EN300-7355477_1_3 |
|
−0.5 ± 0.4 |
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||||
RUN9983 | MAT-POS-b3e365b9-1_1 |
|
EN300-70489_1_2 |
|
−0.5 ± 0.2 |
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||||
RUN7859 | MAT-POS-b3e365b9-1_1 |
|
EN300-101291_2_1 |
|
−0.5 ± 0.4 |
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||||
RUN8953 | MAT-POS-b3e365b9-1_1 |
|
EN300-22245_4_1 |
|
−0.5 ± 0.3 |
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||||
RUN5600 | MAT-POS-b3e365b9-1_1 |
|
EN300-246178_1_2 |
|
−0.5 ± 0.4 |
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||||
RUN11300 | MAT-POS-b3e365b9-1_1 |
|
EN300-7435400_3_1 |
|
−0.5 ± 0.3 |
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||||
RUN10602 | MAT-POS-b3e365b9-1_1 |
|
EN300-1709410_1_3 |
|
−0.5 ± 0.3 |
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||||
RUN5485 | MAT-POS-b3e365b9-1_1 |
|
EN300-1589101_2_1 |
|
−0.5 ± 0.3 |
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||||
RUN9235 | MAT-POS-b3e365b9-1_1 |
|
EN300-1932780_4_2 |
|
−0.5 ± 0.3 |
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||||
RUN9044 | MAT-POS-b3e365b9-1_1 |
|
EN300-103979_1_1 |
|
−0.5 ± 0.3 |
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||||
RUN5111 | MAT-POS-b3e365b9-1_1 |
|
EN300-109920_1_4 |
|
−0.5 ± 0.4 |
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||||
RUN25 | MAT-POS-b3e365b9-1_1 |
|
BEN-DND-c852c98b-1_1 |
|
−0.47 ± 0.04 |
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||||
RUN10957 | MAT-POS-b3e365b9-1_1 |
|
EN300-25702_4_1 |
|
−0.5 ± 0.3 |
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||||
RUN3367 | MAT-POS-b3e365b9-1_1 |
|
EN300-249421_2_2 |
|
−0.5 ± 0.4 |
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||||
RUN10418 | MAT-POS-b3e365b9-1_1 |
|
EN300-304695_3_1 |
|
−0.5 ± 0.3 |
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||||
RUN6204 | MAT-POS-b3e365b9-1_1 |
|
EN300-76584_1_1 |
|
−0.5 ± 0.2 |
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||||
RUN4241 | MAT-POS-b3e365b9-1_1 |
|
EN300-155362_1_2 |
|
−0.5 ± 0.2 |
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||||
RUN10374 | MAT-POS-b3e365b9-1_1 |
|
EN300-124904_1_1 |
|
−0.5 ± 0.3 |
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||||
RUN4809 | MAT-POS-b3e365b9-1_1 |
|
EN300-43047_1_1 |
|
−0.5 ± 0.2 |
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||||
RUN10324 | MAT-POS-b3e365b9-1_1 |
|
EN300-1272529_1_1 |
|
−0.5 ± 0.3 |
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||||
RUN3113 | MAT-POS-b3e365b9-1_1 |
|
EN300-49064_2_1 |
|
−0.5 ± 0.2 |
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||||
RUN8079 | MAT-POS-b3e365b9-1_1 |
|
EN300-1726153_2_1 |
|
−0.5 ± 0.3 |
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||||
RUN5413 | MAT-POS-b3e365b9-1_1 |
|
EN300-6729572_2_8 |
|
−0.5 ± 0.3 |
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||||
RUN7804 | MAT-POS-b3e365b9-1_1 |
|
EN300-173536_1_2 |
|
−0.5 ± 0.2 |
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||||
RUN10428 | MAT-POS-b3e365b9-1_1 |
|
EN300-54304_3_1 |
|
−0.5 ± 0.3 |
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||||
RUN1810 | MAT-POS-b3e365b9-1_1 |
|
EN300-23648_2_1 |
|
−0.5 ± 0.2 |
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||||
RUN1240 | MAT-POS-b3e365b9-1_1 |
|
EN300-62574_1_1 |
|
−0.5 ± 0.2 |
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||||
RUN6831 | MAT-POS-b3e365b9-1_1 |
|
EN300-82616_2_1 |
|
−0.5 ± 0.3 |
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||||
RUN4613 | MAT-POS-b3e365b9-1_1 |
|
EN300-15368_1_1 |
|
−0.5 ± 0.3 |
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||||
RUN1559 | MAT-POS-b3e365b9-1_1 |
|
EN300-6482967_4_1 |
|
−0.5 ± 0.3 |
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||||
RUN6996 | MAT-POS-b3e365b9-1_1 |
|
EN300-214189_1_1 |
|
−0.5 ± 0.3 |
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||||
RUN5772 | MAT-POS-b3e365b9-1_1 |
|
EN300-373435_1_1 |
|
−0.5 ± 0.3 |
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||||
RUN9334 | MAT-POS-b3e365b9-1_1 |
|
EN300-199290_1_1 |
|
−0.5 ± 0.3 |
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||||
RUN11126 | MAT-POS-b3e365b9-1_1 |
|
EN300-07752_1_3 |
|
−0.5 ± 0.3 |
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||||
RUN8894 | MAT-POS-b3e365b9-1_1 |
|
EN300-128431_1_1 |
|
−0.5 ± 0.3 |
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||||
RUN10015 | MAT-POS-b3e365b9-1_1 |
|
EN300-100768_1_2 |
|
−0.5 ± 0.3 |
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||||
RUN7012 | MAT-POS-b3e365b9-1_1 |
|
EN300-366852_1_2 |
|
−0.5 ± 0.4 |
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||||
RUN9221 | MAT-POS-b3e365b9-1_1 |
|
EN300-1253092_1_2 |
|
−0.5 ± 0.3 |
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||||
RUN2515 | MAT-POS-b3e365b9-1_1 |
|
EN300-70092_1_1 |
|
−0.5 ± 0.5 |
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||||
RUN7167 | MAT-POS-b3e365b9-1_1 |
|
EN300-1681046_2_1 |
|
−0.5 ± 0.3 |
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||||
RUN561 | MAT-POS-b3e365b9-1_1 |
|
EN300-203853_1_1 |
|
−0.5 ± 0.5 |
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||||
RUN920 | MAT-POS-b3e365b9-1_1 |
|
EN300-52467_1_1 |
|
−0.5 ± 0.3 |
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||||
RUN2345 | MAT-POS-b3e365b9-1_1 |
|
EN300-393148_1_1 |
|
−0.5 ± 0.3 |
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||||
RUN1016 | MAT-POS-b3e365b9-1_1 |
|
EN300-35592_1_1 |
|
−0.5 ± 0.3 |
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||||
RUN4022 | MAT-POS-b3e365b9-1_1 |
|
EN300-300217_2_3 |
|
−0.5 ± 0.3 |
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||||
RUN9516 | MAT-POS-b3e365b9-1_1 |
|
EN300-1699797_1_1 |
|
−0.5 ± 0.3 |
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||||
RUN1740 | MAT-POS-b3e365b9-1_1 |
|
EN300-316216_1_1 |
|
−0.5 ± 0.3 |
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||||
RUN7034 | MAT-POS-b3e365b9-1_1 |
|
EN300-311920_1_1 |
|
−0.5 ± 0.3 |
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||||
RUN5389 | MAT-POS-b3e365b9-1_1 |
|
EN300-97300_2_4 |
|
−0.5 ± 0.2 |
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||||
RUN5850 | MAT-POS-b3e365b9-1_1 |
|
EN300-6277108_3_1 |
|
−0.5 ± 0.4 |
![]() |
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||||
RUN4723 | MAT-POS-b3e365b9-1_1 |
|
EN300-6479181_3_2 |
|
−0.5 ± 0.3 |
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||||
RUN9991 | MAT-POS-b3e365b9-1_1 |
|
EN300-24653_1_1 |
|
−0.5 ± 0.4 |
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![]() |
||||
RUN11073 | MAT-POS-b3e365b9-1_1 |
|
EN300-36845_4_1 |
|
−0.5 ± 0.4 |
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||||
RUN6782 | MAT-POS-b3e365b9-1_1 |
|
EN300-385267_1_2 |
|
−0.5 ± 0.3 |
![]() |
![]() |
||||
RUN2777 | MAT-POS-b3e365b9-1_1 |
|
EN300-152337_2_1 |
|
−0.5 ± 0.3 |
![]() |
![]() |
||||
RUN8055 | MAT-POS-b3e365b9-1_1 |
|
EN300-70431_2_1 |
|
−0.5 ± 0.4 |
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![]() |
||||
RUN598 | MAT-POS-b3e365b9-1_1 |
|
EN300-7435544_1_2 |
|
−0.5 ± 0.3 |
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![]() |
||||
RUN5349 | MAT-POS-b3e365b9-1_1 |
|
EN300-246440_2_1 |
|
−0.5 ± 0.4 |
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||||
RUN8907 | MAT-POS-b3e365b9-1_1 |
|
EN300-6737762_3_2 |
|
−0.5 ± 0.4 |
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||||
RUN7182 | MAT-POS-b3e365b9-1_1 |
|
EN300-174561_1_1 |
|
−0.5 ± 0.3 |
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||||
RUN10821 | MAT-POS-b3e365b9-1_1 |
|
EN300-255496_4_1 |
|
−0.5 ± 0.3 |
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||||
RUN1718 | MAT-POS-b3e365b9-1_1 |
|
EN300-103187_4_1 |
|
−0.5 ± 0.4 |
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||||
RUN7393 | MAT-POS-b3e365b9-1_1 |
|
EN300-173020_2_1 |
|
−0.5 ± 0.3 |
![]() |
![]() |
||||
RUN4369 | MAT-POS-b3e365b9-1_1 |
|
EN300-220194_1_2 |
|
−0.5 ± 0.3 |
![]() |
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||||
RUN55 | MAT-POS-b3e365b9-1_1 |
|
PET-UNK-29afea89-2_1 |
|
−0.5 ± 0.1 |
![]() |
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||||
RUN8698 | MAT-POS-b3e365b9-1_1 |
|
EN300-7493197_1_1 |
|
−0.4 ± 0.3 |
![]() |
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||||
RUN1835 | MAT-POS-b3e365b9-1_1 |
|
EN300-1706036_3_2 |
|
−0.4 ± 0.3 |
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