43 research outputs found

    Monte Carlo simulation for the adsorption and separation of linear and branched alkanes in IRMQF-1

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    10.1021/la060506gLangmuir22135702-5707LANG

    Capillary phase transitions of linear and branched alkanes in carbon nanotubes from molecular simulation

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    10.1021/la0608720Langmuir22177391-7399LANG

    Water in hydrated orthorhombic lysozyme crystal: Insight from atomistic simulations

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    Journal of Chemical Physics1297-JCPS
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