RUN | Initial microstate | Final microstate | ΔΔG / kcal M-1 | Work distribution | Convergence | ||||||
---|---|---|---|---|---|---|---|---|---|---|---|
RUN8760 | MAT-POS-b3e365b9-1_1 |
|
EN300-1719143_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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RUN420 | MAT-POS-b3e365b9-1_1 |
|
EN300-19700_4_1 |
|
−1.2 ± 0.3 |
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||||
RUN8394 | MAT-POS-b3e365b9-1_1 |
|
EN300-1271924_1_1 |
|
−1.1 ± 0.3 |
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RUN1266 | MAT-POS-b3e365b9-1_1 |
|
EN300-31969_3_1 |
|
−1.1 ± 0.4 |
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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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||||
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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||||
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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||||
RUN309 | MAT-POS-b3e365b9-1_1 |
|
EN300-6238494_1_2 |
|
−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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||||
RUN5047 | MAT-POS-b3e365b9-1_1 |
|
EN300-202922_3_3 |
|
−1.1 ± 0.3 |
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RUN4035 | MAT-POS-b3e365b9-1_1 |
|
EN300-7471076_1_3 |
|
−1.1 ± 0.3 |
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||||
RUN6609 | MAT-POS-b3e365b9-1_1 |
|
EN300-24014_3_2 |
|
−1.1 ± 0.5 |
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||||
RUN9738 | MAT-POS-b3e365b9-1_1 |
|
EN300-45049_3_1 |
|
−1.1 ± 0.3 |
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||||
RUN8176 | MAT-POS-b3e365b9-1_1 |
|
EN300-69556_3_1 |
|
−1.1 ± 0.5 |
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||||
RUN4944 | MAT-POS-b3e365b9-1_1 |
|
EN300-7465222_2_1 |
|
−1.1 ± 0.2 |
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RUN555 | MAT-POS-b3e365b9-1_1 |
|
EN300-219020_4_1 |
|
−1.1 ± 0.3 |
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||||
RUN5644 | MAT-POS-b3e365b9-1_1 |
|
EN300-6744028_1_1 |
|
−1.1 ± 0.3 |
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RUN4029 | MAT-POS-b3e365b9-1_1 |
|
EN300-14767_1_2 |
|
−1.1 ± 0.3 |
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||||
RUN4970 | MAT-POS-b3e365b9-1_1 |
|
EN300-248888_2_1 |
|
−1.1 ± 0.3 |
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||||
RUN2628 | MAT-POS-b3e365b9-1_1 |
|
EN300-07936_1_1 |
|
−1.1 ± 0.4 |
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||||
RUN4781 | MAT-POS-b3e365b9-1_1 |
|
EN300-211203_1_2 |
|
−1.1 ± 0.4 |
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RUN2251 | MAT-POS-b3e365b9-1_1 |
|
EN300-79588_3_1 |
|
−1.1 ± 0.3 |
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RUN2541 | MAT-POS-b3e365b9-1_1 |
|
EN300-143449_2_1 |
|
−1.1 ± 0.4 |
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RUN2641 | MAT-POS-b3e365b9-1_1 |
|
EN300-217107_2_4 |
|
−1.1 ± 0.3 |
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||||
RUN7634 | MAT-POS-b3e365b9-1_1 |
|
EN300-50228_1_2 |
|
−1.1 ± 0.3 |
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||||
RUN1645 | MAT-POS-b3e365b9-1_1 |
|
EN300-1706036_2_2 |
|
−1.1 ± 0.3 |
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||||
RUN6661 | MAT-POS-b3e365b9-1_1 |
|
EN300-132963_3_1 |
|
−1.1 ± 0.3 |
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||||
RUN10880 | MAT-POS-b3e365b9-1_1 |
|
EN300-6739879_1_2 |
|
−1.1 ± 0.3 |
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||||
RUN10834 | MAT-POS-b3e365b9-1_1 |
|
EN300-267855_1_1 |
|
−1.1 ± 0.3 |
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||||
RUN4530 | MAT-POS-b3e365b9-1_1 |
|
EN300-305996_2_1 |
|
−1.1 ± 0.3 |
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||||
RUN11298 | MAT-POS-b3e365b9-1_1 |
|
EN300-1212400_1_4 |
|
−1.1 ± 0.3 |
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||||
RUN1140 | MAT-POS-b3e365b9-1_1 |
|
EN300-1699871_3_1 |
|
−1.1 ± 0.3 |
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||||
RUN5281 | MAT-POS-b3e365b9-1_1 |
|
EN300-205680_2_1 |
|
−1.1 ± 0.4 |
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||||
RUN9083 | MAT-POS-b3e365b9-1_1 |
|
EN300-206769_1_1 |
|
−1.1 ± 0.3 |
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||||
RUN403 | MAT-POS-b3e365b9-1_1 |
|
EN300-1241327_2_1 |
|
−1.1 ± 0.2 |
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