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Free energy contributions coming from molecular mechanics and PB calculations.

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Figshare2015-12-02 更新2026-04-29 收录
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https://figshare.com/articles/dataset/_Free_energy_contributions_coming_from_molecular_mechanics_and_PB_calculations_/458803
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All values in the table are in kcal/mol unit. Standard errors of corresponding values are given in parentheses.For each structure, mean values of the contributions for different dielectric constants are represented.
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2015-12-02
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