RUN | Initial microstate | Final microstate | ΔΔG / kcal M-1 | Work distribution | Convergence | ||||||
---|---|---|---|---|---|---|---|---|---|---|---|
RUN7667 | MAT-POS-8a69d52e-7_1 |
|
EN300-256579_1_1 |
|
5.5 ± 0.5 |
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RUN14149 | MAT-POS-8a69d52e-7_1 |
|
EN300-227398_2_3 |
|
5.6 ± 0.4 |
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RUN1694 | MAT-POS-8a69d52e-7_1 |
|
EN300-199149_2_2 |
|
5.6 ± 0.4 |
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RUN4336 | MAT-POS-8a69d52e-7_1 |
|
EN300-254554_2_1 |
|
5.6 ± 0.5 |
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RUN12051 | MAT-POS-8a69d52e-7_1 |
|
EN300-1702911_2_1 |
|
5.7 ± 0.3 |
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RUN7635 | MAT-POS-8a69d52e-7_1 |
|
EN300-12626_1_1 |
|
6.0 ± 0.6 |
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RUN10052 | MAT-POS-8a69d52e-7_1 |
|
EN300-7427798_2_1 |
|
6.1 ± 0.3 |
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RUN3857 | MAT-POS-8a69d52e-7_1 |
|
EN300-257393_1_1 |
|
6.2 ± 0.4 |
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RUN14153 | MAT-POS-8a69d52e-7_1 |
|
EN300-227398_2_3 |
|
6.3 ± 0.5 |
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RUN10000 | MAT-POS-8a69d52e-7_1 |
|
EN300-227398_2_2 |
|
6.4 ± 0.5 |
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RUN4716 | MAT-POS-8a69d52e-7_1 |
|
EN300-52212_2_2 |
|
6.4 ± 0.5 |
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RUN5432 | MAT-POS-8a69d52e-7_1 |
|
EN300-300044_2_1 |
|
6.6 ± 0.5 |
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RUN3400 | MAT-POS-8a69d52e-7_1 |
|
EN300-207543_2_2 |
|
6.7 ± 0.4 |
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RUN4048 | MAT-POS-8a69d52e-7_1 |
|
EN300-184355_2_1 |
|
6.9 ± 0.5 |
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RUN12687 | MAT-POS-8a69d52e-7_1 |
|
EN300-74856_2_1 |
|
7.6 ± 0.2 |
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RUN14065 | MAT-POS-8a69d52e-7_1 |
|
EN300-7426383_4_1 |
|
8.0 ± 0.3 |
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RUN8285 | MAT-POS-8a69d52e-7_1 |
|
EN300-208959_2_3 |
|
8.6 ± 0.2 |
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RUN8678 | MAT-POS-8a69d52e-7_1 |
|
EN300-208959_2_1 |
|
8.9 ± 0.3 |
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RUN3070 | MAT-POS-8a69d52e-7_1 |
|
EN300-208959_1_4 |
|
10.4 ± 0.2 |
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