Sadeghi Sina, Vink R L C
Institute of Theoretical Physics, Georg-August-Universität Göttingen, Friedrich-Hund-Platz 1, D-37077 Göttingen, Germany.
Phys Rev E Stat Nonlin Soft Matter Phys. 2012 Jun;85(6 Pt 1):061912. doi: 10.1103/PhysRevE.85.061912. Epub 2012 Jun 18.
We consider the main transition in single-component membranes using computer simulations of the Pink model [D. A. Pink et al., Biochemistry 19, 349 (1980)]. We first show that the accepted parameters of the Pink model yield a main transition temperature that is systematically below experimental values. This resolves an issue that was first pointed out by Corvera and co-workers [Phys. Rev. E 47, 696 (1993)]. In order to yield the correct transition temperature, the strength of the van der Waals coupling in the Pink model must be increased; by using finite-size scaling, a set of optimal values is proposed. We also provide finite-size scaling evidence that the Pink model belongs to the universality class of the two-dimensional Ising model. This finding holds irrespective of the number of conformational states. Finally, we address the main transition in the presence of quenched disorder, which may arise in situations where the membrane is deposited on a rough support. In this case, we observe a stable multidomain structure of gel and fluid domains, and the absence of a sharp transition in the thermodynamic limit.
我们使用平克模型[D. A. 平克等人,《生物化学》19, 349 (1980)]的计算机模拟来研究单组分膜中的主要转变。我们首先表明,平克模型公认的参数所产生的主要转变温度系统地低于实验值。这解决了科尔韦拉及其同事[《物理评论E》47, 696 (1993)]首次指出的一个问题。为了得到正确的转变温度,平克模型中范德华耦合的强度必须增加;通过使用有限尺寸标度,我们提出了一组最优值。我们还提供了有限尺寸标度证据,表明平克模型属于二维伊辛模型的普适类。这一发现与构象状态的数量无关。最后,我们研究了存在淬火无序时的主要转变,淬火无序可能出现在膜沉积在粗糙支撑物上的情况中。在这种情况下,我们观察到凝胶域和流体域的稳定多域结构,并且在热力学极限下不存在尖锐的转变。