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通过非手性和手性活性粒子对聚合物通过纳米孔的传输进行校正。

Rectification of polymer translocation through nanopores by nonchiral and chiral active particles.

机构信息

School of Nano Science, Institute for Research in Fundamental Sciences (IPM), Tehran 19538-33511, Iran.

School of Physics, Institute for Research in Fundamental Sciences (IPM), Tehran 19538-33511, Iran.

出版信息

Phys Rev E. 2023 Feb;107(2-1):024602. doi: 10.1103/PhysRevE.107.024602.

Abstract

We study translocation of a flexible polymer chain through a membrane pore under the influence of active forces and steric exclusion using Langevin dynamics simulations within a minimal two-dimensional model. The active forces on the polymer are imparted by nonchiral and chiral active particles that are introduced on one side or both sides of a rigid membrane positioned across the midline of a confining box. We show that the polymer can translocate through the pore to either side of the dividing membrane in the absence of external forcing. Translocation of the polymer to a given side of the membrane is driven (hindered) by an effective pulling (pushing) exerted by the active particles that are present on that side. The effective pulling results from accumulation of active particles around the polymer. This crowding effect signifies persistent motion of active particles causing prolonged detention times for them close to the confining walls and the polymer. The effective pushing that hinders the translocation, on the other hand, results from steric collisions that occur between the polymer and active particles. As a result of the competition between these effective forces, we find a transition between two rectified cis-to-trans and trans-to-cis translocation regimes. This transition is identified by a sharp peak in the average translocation time. The effects of active particles on the transition is studied by analyzing how the translocation peak is regulated by the activity (self-propulsion) strength of these particles, their area fraction, and chirality strength.

摘要

我们使用朗之万动力学模拟,在一个最小的二维模型中,研究了在活性力和空间位阻的影响下,柔性聚合物链通过膜孔的输运。聚合物上的活性力是由非手性和手性活性粒子施加的,这些活性粒子被引入到刚性膜的一侧或两侧,该刚性膜位于限制盒的中线的两侧。我们表明,在没有外部作用力的情况下,聚合物可以通过孔迁移到分隔膜的任一侧。聚合物向膜的给定侧的迁移被存在于该侧的活性粒子施加的有效拉力(阻力)驱动(阻碍)。有效拉力是由于活性粒子在聚合物周围的积累而产生的。这种拥挤效应标志着活性粒子的持续运动,导致它们在靠近限制壁和聚合物的地方停留时间延长。另一方面,阻碍迁移的有效推动则是由于聚合物和活性粒子之间发生的空间位阻碰撞。由于这些有效力之间的竞争,我们发现了两种纠正的顺式到反式和反式到顺式的迁移转变。这种转变是通过平均迁移时间的急剧峰值来识别的。通过分析这些粒子的活性(自推进)强度、面积分数和手性强度如何调节迁移峰值,研究了活性粒子对转变的影响。

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