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      Extremely precise free energy calculations of amino acid side chain analogs: Comparison of common molecular mechanics force fields for proteins

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      The Journal of Chemical Physics
      AIP Publishing

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          Rattle: A “velocity” version of the shake algorithm for molecular dynamics calculations

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            Optimized intermolecular potential functions for liquid hydrocarbons

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              Avoiding singularities and numerical instabilities in free energy calculations based on molecular simulations

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                Author and article information

                Journal
                The Journal of Chemical Physics
                The Journal of Chemical Physics
                AIP Publishing
                0021-9606
                1089-7690
                September 15 2003
                September 15 2003
                : 119
                : 11
                : 5740-5761
                Article
                10.1063/1.1587119
                e1973777-6ee5-47c3-b183-2fbfa45223e9
                © 2003
                History

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