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Effects of topology and size on statics and dynamics of complexes of hyperbranched polymers with linear polyelectrolytes

机译:拓扑结构和尺寸对超支化聚合物与线性聚电解质配合物静态和动力学的影响

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摘要

Brownian dynamics simulations with explicit hydrodynamic interactions have been employed to study generic effects of size and topology in noncovalent (Coulombic-driven) complexes formed by irregular-shaped hyperbranched polymers and linear polyelectrolytes.The behavior of the complexes was explored in detail in terms of static and dynamic properties,both in local and in the entire complex scale.The results were compared to previous studies on perfect dendrimers and other hyperbranched molecules where available.It was found that both molecular weight and structure may impart significant changes to key factors known to be associated with the ability of these systems to take part in relevant nanoscale applications.
机译:布朗动力学模拟具有明确的水动力相互作用,已用于研究由不规则形状的超支化聚合物和线性聚电解质形成的非共价(库仑驱动的)配合物的尺寸和拓扑结构的通用效应,并从静态角度详细探讨了配合物的行为。结果与以前对完善的树枝状聚合物和其他超支化分子(如果有)的研究进行了比较。结果发现,分子量和结构都可能对已知的关键因素产生重大变化。这些系统参与相关的纳米级应用的能力。

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