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三元脂质膜中的相分离:从蒙特卡罗模拟到金兹堡-朗道方程

Phase separation in three-component lipid membranes: from Monte Carlo simulations to Ginzburg-Landau equations.

作者信息

Reigada Ramon, Buceta Javier, Gómez Jordi, Sagués Francesc, Lindenberg Katja

机构信息

Departament de Química-Física, Universitat de Barcelona, Avda. Diagonal 647, 08028 Barcelona, Spain.

出版信息

J Chem Phys. 2008 Jan 14;128(2):025102. doi: 10.1063/1.2817333.

Abstract

Preferential affinity of cholesterol for saturated rather than unsaturated lipids underlies the thermodynamic process of the formation of lipid nanostructures in cell membranes, that is, of rafts. In this context, phase segregation of two-dimensional ternary lipid mixtures is formally studied from two different perspectives. The simplest approach is based on Monte Carlo simulations of an Ising model corresponding to two interconnected lattices, from which the basic features of the phenomenon are investigated. Then, the coarse-graining mean field procedure of the discrete Hamiltonian is adapted and a Ginzburg-Landau-like free energy expression is obtained. From this latter description, we construct kinetic equations that enable us to perform numerical simulations and to establish analytical phase separation criteria. Application of our formalism in the biological context is also discussed.

摘要

胆固醇对饱和脂质而非不饱和脂质的优先亲和力是细胞膜中脂质纳米结构(即脂筏)形成的热力学过程的基础。在此背景下,从两个不同的角度对二维三元脂质混合物的相分离进行了形式上的研究。最简单的方法是基于对应于两个相互连接晶格的伊辛模型的蒙特卡罗模拟,从中研究该现象的基本特征。然后,对离散哈密顿量的粗粒化平均场过程进行了调整,得到了类似金兹堡 - 朗道的自由能表达式。从后一种描述中,我们构建了动力学方程,使我们能够进行数值模拟并建立分析相分离标准。还讨论了我们的形式体系在生物学背景下的应用。

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