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Adsorption of comb copolymers on weakly attractive solid surfaces

机译:梳形共聚物在弱吸引力固体表面上的吸附

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In this work continuum and lattice Monte Carlo simulation methods are used to study the adsorption of linear and comb polymers on flat surfaces. Selected polymer segments, located at the tips of the side chains in comb polymers or equally spaced along the linear polymers, are attracted to each other and to the surface via square-well potentials. The rest of the polymer segments are modeled as tangent hard spheres in the continuum model and as self-avoiding random walks in the lattice model. Results are presented in terms of segment-density profiles, distribution functions, and radii of gyration of the adsorbed polymers. At infinite dilution the presence of short side chains promotes the adsorption of polymers favoring both a decrease in the depletion-layer thickness and a spreading of the polymer molecule on the surface. The presence of long side chains favors the adsorption of polymers on the surface, but does not permit the spreading of the polymers. At finite concentration linear polymers and comb polymers with long side chains readily adsorb on the solid surface, while comb polymers with short side chains are unlikely to adsorb. The simple models of comb copolymers with short side chains used here show properties similar to those of associating polymers and of globular proteins in aqueous solutions, and can be used as a first approximation to investigate the mechanism of adsorption of proteins onto hydrophobic surfaces. (C) 2005 American Institute of Physics.
机译:在这项工作中,使用连续体和晶格蒙特卡罗模拟方法研究线性和梳状聚合物在平坦表面上的吸附。位于梳形聚合物中侧链末端或沿线性聚合物等距分布的选定聚合物链段通过方阱势能相互吸引,并吸引至表面。其余的聚合物链段在连续介质模型中建模为切线硬球,在晶格模型中建模为自回避随机游走。结果以链段密度分布,分布函数和吸附聚合物的回转半径表示。在无限稀释下,短侧链的存在促进了聚合物的吸附,有利于减少耗尽层的厚度以及有利于聚合物分子在表面上的扩散。长侧链的存在有利于聚合物在表面上的吸附,但不允许聚合物散布。在有限浓度下,具有长侧链的线性聚合物和梳形聚合物很容易吸附在固体表面上,而具有短侧链的梳形聚合物则不太可能被吸附。这里使用的带有短侧链的梳状共聚物的简单模型显示出与水溶液中的缔合聚合物和球状蛋白质相似的性质,可以用作研究蛋白质在疏水性表面上吸附机理的第一近似值。 (C)2005美国物理研究所。

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