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December 22, 2017 article Open access

Calculation of Diffusion Coefficients through Coarse-Grained Simulations Using the Automated-Fragmentation-Parametrization Method and the Recovery of Wilke–Chang Statistical Correlation

Journal of Chemical Theory and Computation

DOI: 10.1021/acs.jctc.7b01093 Full text (OA) OpenAlex

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