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Effects of electrostatic interactions on the translocation of polymers through a narrow pore under different solvent conditions: A dissipative particle dynamics simulation study

机译:静电相互作用对不同溶剂条件下聚合物通过窄孔的移位的影响:耗散粒子动力学模拟研究

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摘要

Polymer translocation through a narrow pore is investigated using a particle-based dissipative particle dynamics (DPD) method. A rigid core is included in each particle to avoid particle interpenetration problems based on the original DPD method. Electrostatic interactions of charged particles are simply represented via screened Coulombic interactions. The average translocation time τ versus polymer length N satisfies the scaling law τ ~ N ~β. The scaling exponent β depends on solvent quality. The results demonstrate that solvent quality exerts a considerable influence on the dynamics of translocation of polymers. The findings may help facilitate understanding of the dynamic behaviors of various polymer and DNA molecules during translocation processes.
机译:使用基于粒子的耗散粒子动力学(DPD)方法研究了聚合物通过狭窄孔的移位。每个粒子中都包含一个刚性核,以避免基于原始DPD方法的粒子互穿问题。带电粒子的静电相互作用仅通过筛选的库仑相互作用来表示。平均移位时间τ与聚合物长度N的关系满足比例定律τ〜N〜β。标度指数β取决于溶剂质量。结果表明,溶剂质量对聚合物的移位动力学有很大影响。这些发现可能有助于促进对易位过程中各种聚合物和DNA分子的动态行为的理解。

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