首页> 外文期刊>International Journal of Modern Physics, C. Physics and Computers >EXPLORING DNA TRANSLOCATION THROUGH A NANOPORE VIA A MULTISCALE LATTICE-BOLTZMANN MOLECULAR-DYNAMICS METHODOLOGY
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EXPLORING DNA TRANSLOCATION THROUGH A NANOPORE VIA A MULTISCALE LATTICE-BOLTZMANN MOLECULAR-DYNAMICS METHODOLOGY

机译:通过多尺度格子-博茨曼分子动力学方法研究纳米孔中的DNA转运

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摘要

A multiscale approach is used to simulate the translocation of DNA through a nanopore. Within this scheme, the interactions of the molecule with the surrounding fluid (solvent) are explicitly taken into account. By generating polymers of various initial configurations and lengths we map the probability distibutions of the passage times of the DNA through the nanopore. A scaling law behavior for the most probable of these times with respect to length is derived, and shown to exhibit an exponent that is in a good agreement with the experimental findings. The essential features of the DNA dynamics as it passes through the pore are explored.
机译:多尺度方法用于模拟DNA通过纳米孔的转运。在该方案中,明确考虑了分子与周围流体(溶剂)的相互作用。通过生成各种初始构型和长度的聚合物,我们绘制了DNA通过纳米孔的时间分布的概率分布图。得出了在这些时间中最可能发生的关于长度的缩放定律行为,并显示出与实验结果非常吻合的指数。探索了DNA动力学穿过孔时的基本特征。

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