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Osmotic Second Virial Coefficients and Phase Diagrams for Aqueous Proteins from a Much-Improved Poisson−Boltzmann Equation

Lima, Eduardo R. A. ; Biscaia, Evaristo C. ; Boström, Mathias ; Tavares, Frederico W. ; Prausnitz, John M.



Abstract

A much-improved Poisson -Boltzmann equation for two globular proteins using bispherical coordinates is used to establish the potential of mean force (PMF) between two globular lysozyme particles. Calculations presented here include previously ignored ion-protein none ectro static potentials. The lysozyme-lysozyme PMF is used to calculate osmotic second virial coeffiencients. The theoretical PMF ...

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