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Optimized Baxter model of protein solutions: electrostatics versus adhesion.

作者信息

Prinsen Peter, Odijk Theo

机构信息

Complex Fluids Theory, Faculty of Applied Sciences, Delft University of Technology, Delft, The Netherlands.

出版信息

J Chem Phys. 2004 Oct 1;121(13):6525-37. doi: 10.1063/1.1786915.

Abstract

A theory is set up of spherical proteins interacting by screened electrostatics and constant adhesion, in which the effective adhesion parameter is optimized by a variational principle for the free energy. An analytical approach to the second virial coefficient is first outlined by balancing the repulsive electrostatics against part of the bare adhesion. A theory similar in spirit is developed at nonzero concentrations by assuming an appropriate Baxter model as the reference state. The first-order term in a functional expansion of the free energy is set equal to zero which determines the effective adhesion as a function of salt and protein concentrations. The resulting theory is shown to have fairly good predictive power for the ionic-strength dependence of both the second virial coefficient and the osmotic pressure or compressibility of lysozyme up to about 0.2 volume fraction.

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