RUN | Initial microstate | Final microstate | ΔΔG / kcal M-1 | Work distribution | Convergence | ||||||
---|---|---|---|---|---|---|---|---|---|---|---|
RUN1939 | MAT-POS-b3e365b9-1_1 |
|
EN300-211482_3_1 |
|
−1.2 ± 0.3 |
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||||
RUN8760 | MAT-POS-b3e365b9-1_1 |
|
EN300-1719143_1_1 |
|
−1.2 ± 0.3 |
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||||
RUN7146 | MAT-POS-b3e365b9-1_1 |
|
EN300-7494324_1_1 |
|
−1.2 ± 0.3 |
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||||
RUN4601 | MAT-POS-b3e365b9-1_1 |
|
EN300-178829_1_1 |
|
−1.2 ± 0.3 |
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||||
RUN4028 | MAT-POS-b3e365b9-1_1 |
|
EN300-142130_2_1 |
|
−1.2 ± 0.4 |
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||||
RUN9698 | MAT-POS-b3e365b9-1_1 |
|
EN300-383904_3_1 |
|
−1.2 ± 0.4 |
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||||
RUN3054 | MAT-POS-b3e365b9-1_1 |
|
EN300-31210_1_2 |
|
−1.2 ± 0.4 |
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||||
RUN8656 | MAT-POS-b3e365b9-1_1 |
|
EN300-300294_1_1 |
|
−1.2 ± 0.3 |
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||||
RUN4921 | MAT-POS-b3e365b9-1_1 |
|
EN300-173023_1_1 |
|
−1.2 ± 0.3 |
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||||
RUN2750 | MAT-POS-b3e365b9-1_1 |
|
EN300-54304_1_1 |
|
−1.2 ± 0.3 |
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||||
RUN844 | MAT-POS-b3e365b9-1_1 |
|
EN300-178293_3_1 |
|
−1.2 ± 0.4 |
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||||
RUN6251 | MAT-POS-b3e365b9-1_1 |
|
EN300-61636_1_1 |
|
−1.2 ± 0.3 |
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||||
RUN7715 | MAT-POS-b3e365b9-1_1 |
|
EN300-685492_2_1 |
|
−1.2 ± 0.4 |
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||||
RUN9835 | MAT-POS-b3e365b9-1_1 |
|
EN300-7499295_2_1 |
|
−1.2 ± 0.3 |
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||||
RUN10645 | MAT-POS-b3e365b9-1_1 |
|
EN300-2007627_2_2 |
|
−1.2 ± 0.6 |
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||||
RUN2902 | MAT-POS-b3e365b9-1_1 |
|
EN300-248178_1_1 |
|
−1.2 ± 0.2 |
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||||
RUN6906 | MAT-POS-b3e365b9-1_1 |
|
EN300-6491795_1_1 |
|
−1.2 ± 0.3 |
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||||
RUN6399 | MAT-POS-b3e365b9-1_1 |
|
EN300-6478526_1_1 |
|
−1.2 ± 0.3 |
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||||
RUN420 | MAT-POS-b3e365b9-1_1 |
|
EN300-19700_4_1 |
|
−1.2 ± 0.3 |
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||||
RUN6448 | MAT-POS-b3e365b9-1_1 |
|
EN300-1600363_2_1 |
|
−1.1 ± 0.2 |
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||||
RUN8394 | MAT-POS-b3e365b9-1_1 |
|
EN300-1271924_1_1 |
|
−1.1 ± 0.3 |
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||||
RUN6826 | MAT-POS-b3e365b9-1_1 |
|
EN300-252721_1_1 |
|
−1.1 ± 0.2 |
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||||
RUN1266 | MAT-POS-b3e365b9-1_1 |
|
EN300-31969_3_1 |
|
−1.1 ± 0.4 |
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||||
RUN1944 | MAT-POS-b3e365b9-1_1 |
|
EN300-1932013_2_2 |
|
−1.1 ± 0.3 |
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||||
RUN8502 | MAT-POS-b3e365b9-1_1 |
|
EN300-27476_1_1 |
|
−1.1 ± 0.4 |
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||||
RUN9614 | MAT-POS-b3e365b9-1_1 |
|
EN300-126104_3_1 |
|
−1.1 ± 0.3 |
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||||
RUN6950 | MAT-POS-b3e365b9-1_1 |
|
EN300-312450_1_1 |
|
−1.1 ± 0.3 |
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||||
RUN1152 | MAT-POS-b3e365b9-1_1 |
|
EN300-23223_1_1 |
|
−1.1 ± 0.3 |
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||||
RUN9071 | MAT-POS-b3e365b9-1_1 |
|
EN300-307053_1_1 |
|
−1.1 ± 0.3 |
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||||
RUN2566 | MAT-POS-b3e365b9-1_1 |
|
EN300-68889_1_1 |
|
−1.1 ± 0.2 |
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||||
RUN40 | MAT-POS-b3e365b9-1_1 |
|
PET-UNK-29afea89-1_1 |
|
−1.1 ± 0.1 |
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||||
RUN1982 | MAT-POS-b3e365b9-1_1 |
|
EN300-20496_4_2 |
|
−1.1 ± 0.3 |
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||||
RUN1272 | MAT-POS-b3e365b9-1_1 |
|
EN300-174603_1_1 |
|
−1.1 ± 0.2 |
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||||
RUN5309 | MAT-POS-b3e365b9-1_1 |
|
EN300-88656_2_2 |
|
−1.1 ± 0.3 |
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||||
RUN1346 | MAT-POS-b3e365b9-1_1 |
|
EN300-223741_3_1 |
|
−1.1 ± 0.3 |
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||||
RUN6308 | MAT-POS-b3e365b9-1_1 |
|
EN300-1662365_2_1 |
|
−1.1 ± 0.3 |
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||||
RUN7114 | MAT-POS-b3e365b9-1_1 |
|
EN300-139268_1_1 |
|
−1.1 ± 0.2 |
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||||
RUN10148 | MAT-POS-b3e365b9-1_1 |
|
EN300-07752_1_4 |
|
−1.1 ± 0.4 |
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||||
RUN309 | MAT-POS-b3e365b9-1_1 |
|
EN300-6238494_1_2 |
|
−1.1 ± 0.3 |
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||||
RUN7173 | MAT-POS-b3e365b9-1_1 |
|
EN300-100916_4_1 |
|
−1.1 ± 0.3 |
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||||
RUN2648 | MAT-POS-b3e365b9-1_1 |
|
EN300-178876_3_1 |
|
−1.1 ± 0.3 |
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||||
RUN10333 | MAT-POS-b3e365b9-1_1 |
|
EN300-174668_4_2 |
|
−1.1 ± 0.5 |
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||||
RUN11251 | MAT-POS-b3e365b9-1_1 |
|
EN300-77006_4_1 |
|
−1.1 ± 0.3 |
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||||
RUN8530 | MAT-POS-b3e365b9-1_1 |
|
EN300-208959_1_3 |
|
−1.1 ± 0.3 |
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||||
RUN6921 | MAT-POS-b3e365b9-1_1 |
|
EN300-76387_2_2 |
|
−1.1 ± 0.3 |
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||||
RUN1410 | MAT-POS-b3e365b9-1_1 |
|
EN300-96886_1_1 |
|
−1.1 ± 0.3 |
![]() |
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||||
RUN7918 | MAT-POS-b3e365b9-1_1 |
|
EN300-31969_1_2 |
|
−1.1 ± 0.3 |
![]() |
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||||
RUN5047 | MAT-POS-b3e365b9-1_1 |
|
EN300-202922_3_3 |
|
−1.1 ± 0.3 |
![]() |
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||||
RUN8382 | MAT-POS-b3e365b9-1_1 |
|
EN300-94643_1_1 |
|
−1.1 ± 0.4 |
![]() |
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||||
RUN4035 | MAT-POS-b3e365b9-1_1 |
|
EN300-7471076_1_3 |
|
−1.1 ± 0.3 |
![]() |
![]() |
||||
RUN6609 | MAT-POS-b3e365b9-1_1 |
|
EN300-24014_3_2 |
|
−1.1 ± 0.5 |
![]() |
![]() |
||||
RUN10152 | MAT-POS-b3e365b9-1_1 |
|
EN300-5253939_3_2 |
|
−1.1 ± 0.3 |
![]() |
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||||
RUN11321 | MAT-POS-b3e365b9-1_1 |
|
EN300-72730_4_2 |
|
−1.1 ± 0.3 |
![]() |
![]() |
||||
RUN9738 | MAT-POS-b3e365b9-1_1 |
|
EN300-45049_3_1 |
|
−1.1 ± 0.3 |
![]() |
![]() |
||||
RUN8176 | MAT-POS-b3e365b9-1_1 |
|
EN300-69556_3_1 |
|
−1.1 ± 0.5 |
![]() |
![]() |
||||
RUN5305 | MAT-POS-b3e365b9-1_1 |
|
EN300-148421_2_2 |
|
−1.1 ± 0.4 |
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||||
RUN9401 | MAT-POS-b3e365b9-1_1 |
|
EN300-31998_4_1 |
|
−1.1 ± 0.3 |
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||||
RUN1989 | MAT-POS-b3e365b9-1_1 |
|
EN300-195756_2_2 |
|
−1.1 ± 0.3 |
![]() |
![]() |
||||
RUN4944 | MAT-POS-b3e365b9-1_1 |
|
EN300-7465222_2_1 |
|
−1.1 ± 0.2 |
![]() |
![]() |
||||
RUN694 | MAT-POS-b3e365b9-1_1 |
|
EN300-266117_2_1 |
|
−1.1 ± 0.3 |
![]() |
![]() |
||||
RUN555 | MAT-POS-b3e365b9-1_1 |
|
EN300-219020_4_1 |
|
−1.1 ± 0.3 |
![]() |
![]() |
||||
RUN5644 | MAT-POS-b3e365b9-1_1 |
|
EN300-6744028_1_1 |
|
−1.1 ± 0.3 |
![]() |
![]() |
||||
RUN4029 | MAT-POS-b3e365b9-1_1 |
|
EN300-14767_1_2 |
|
−1.1 ± 0.3 |
![]() |
![]() |
||||
RUN4970 | MAT-POS-b3e365b9-1_1 |
|
EN300-248888_2_1 |
|
−1.1 ± 0.3 |
![]() |
![]() |
||||
RUN2628 | MAT-POS-b3e365b9-1_1 |
|
EN300-07936_1_1 |
|
−1.1 ± 0.4 |
![]() |
![]() |
||||
RUN9630 | MAT-POS-b3e365b9-1_1 |
|
EN300-154942_3_1 |
|
−1.1 ± 0.2 |
![]() |
![]() |
||||
RUN2301 | MAT-POS-b3e365b9-1_1 |
|
EN300-123489_1_1 |
|
−1.1 ± 0.2 |
![]() |
![]() |
||||
RUN6415 | MAT-POS-b3e365b9-1_1 |
|
EN300-14006_1_2 |
|
−1.1 ± 0.3 |
![]() |
![]() |
||||
RUN7730 | MAT-POS-b3e365b9-1_1 |
|
EN300-6478432_1_1 |
|
−1.1 ± 0.4 |
![]() |
![]() |
||||
RUN4781 | MAT-POS-b3e365b9-1_1 |
|
EN300-211203_1_2 |
|
−1.1 ± 0.4 |
![]() |
![]() |
||||
RUN2251 | MAT-POS-b3e365b9-1_1 |
|
EN300-79588_3_1 |
|
−1.1 ± 0.3 |
![]() |
![]() |
||||
RUN6793 | MAT-POS-b3e365b9-1_1 |
|
EN300-395719_2_1 |
|
−1.1 ± 0.3 |
![]() |
![]() |
||||
RUN8120 | MAT-POS-b3e365b9-1_1 |
|
EN300-99161_1_1 |
|
−1.1 ± 0.3 |
![]() |
![]() |
||||
RUN2541 | MAT-POS-b3e365b9-1_1 |
|
EN300-143449_2_1 |
|
−1.1 ± 0.4 |
![]() |
![]() |
||||
RUN187 | MAT-POS-b3e365b9-1_1 |
|
FRA-DIA-b66f7109-3_1 |
|
−1.1 ± 0.2 |
![]() |
![]() |
||||
RUN2641 | MAT-POS-b3e365b9-1_1 |
|
EN300-217107_2_4 |
|
−1.1 ± 0.3 |
![]() |
![]() |
||||
RUN7634 | MAT-POS-b3e365b9-1_1 |
|
EN300-50228_1_2 |
|
−1.1 ± 0.3 |
![]() |
![]() |
||||
RUN1198 | MAT-POS-b3e365b9-1_1 |
|
EN300-216063_2_1 |
|
−1.1 ± 0.3 |
![]() |
![]() |
||||
RUN7446 | MAT-POS-b3e365b9-1_1 |
|
EN300-315854_1_2 |
|
−1.1 ± 0.3 |
![]() |
![]() |
||||
RUN2521 | MAT-POS-b3e365b9-1_1 |
|
EN300-97758_2_1 |
|
−1.1 ± 0.3 |
![]() |
![]() |
||||
RUN1668 | MAT-POS-b3e365b9-1_1 |
|
EN300-7089802_1_1 |
|
−1.1 ± 0.3 |
![]() |
![]() |
||||
RUN1645 | MAT-POS-b3e365b9-1_1 |
|
EN300-1706036_2_2 |
|
−1.1 ± 0.3 |
![]() |
![]() |
||||
RUN3370 | MAT-POS-b3e365b9-1_1 |
|
EN300-1654606_1_1 |
|
−1.1 ± 0.2 |
![]() |
![]() |
||||
RUN8564 | MAT-POS-b3e365b9-1_1 |
|
EN300-72211_3_2 |
|
−1.1 ± 0.3 |
![]() |
![]() |
||||
RUN6661 | MAT-POS-b3e365b9-1_1 |
|
EN300-132963_3_1 |
|
−1.1 ± 0.3 |
![]() |
![]() |
||||
RUN10880 | MAT-POS-b3e365b9-1_1 |
|
EN300-6739879_1_2 |
|
−1.1 ± 0.3 |
![]() |
![]() |
||||
RUN10834 | MAT-POS-b3e365b9-1_1 |
|
EN300-267855_1_1 |
|
−1.1 ± 0.3 |
![]() |
![]() |
||||
RUN2795 | MAT-POS-b3e365b9-1_1 |
|
EN300-250126_1_2 |
|
−1.1 ± 0.3 |
![]() |
![]() |
||||
RUN10806 | MAT-POS-b3e365b9-1_1 |
|
EN300-244403_3_1 |
|
−1.1 ± 0.3 |
![]() |
![]() |
||||
RUN4530 | MAT-POS-b3e365b9-1_1 |
|
EN300-305996_2_1 |
|
−1.1 ± 0.3 |
![]() |
![]() |
||||
RUN11298 | MAT-POS-b3e365b9-1_1 |
|
EN300-1212400_1_4 |
|
−1.1 ± 0.3 |
![]() |
![]() |
||||
RUN7054 | MAT-POS-b3e365b9-1_1 |
|
EN300-6503702_1_1 |
|
−1.1 ± 0.3 |
![]() |
![]() |
||||
RUN1140 | MAT-POS-b3e365b9-1_1 |
|
EN300-1699871_3_1 |
|
−1.1 ± 0.3 |
![]() |
![]() |
||||
RUN5281 | MAT-POS-b3e365b9-1_1 |
|
EN300-205680_2_1 |
|
−1.1 ± 0.4 |
![]() |
![]() |
||||
RUN7662 | MAT-POS-b3e365b9-1_1 |
|
EN300-78121_1_1 |
|
−1.1 ± 0.3 |
![]() |
![]() |
||||
RUN9083 | MAT-POS-b3e365b9-1_1 |
|
EN300-206769_1_1 |
|
−1.1 ± 0.3 |
![]() |
![]() |
||||
RUN8020 | MAT-POS-b3e365b9-1_1 |
|
EN300-7355477_1_8 |
|
−1.1 ± 0.3 |
![]() |
![]() |
||||
RUN7746 | MAT-POS-b3e365b9-1_1 |
|
EN300-6759512_1_1 |
|
−1.1 ± 0.3 |
![]() |
![]() |
||||
RUN7943 | MAT-POS-b3e365b9-1_1 |
|
EN300-7433864_2_1 |
|
−1.1 ± 0.6 |
![]() |
![]() |
||||
RUN403 | MAT-POS-b3e365b9-1_1 |
|
EN300-1241327_2_1 |
|
−1.1 ± 0.2 |
![]() |
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