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Electronic detection of dsDNA transition from helical to zipper conformation using graphene nanopores

机译:使用石墨烯纳米孔电子检测dsDNA从螺旋构象转变为拉链构象

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Mechanical manipulation of DNA by forced extension can lead double-stranded DNA (dsDNA) to structurally transform from a helical form to a linear zipper-like form. By employing classical molecular dynamics and quantum mechanical nonequilibrium Green?s function-based transport simulations, we show the ability of graphene nanopores to discern different dsDNA conformations, in a helical to zipper transition, using transverse electronic conductance. In particular, conductance oscillations due to helical dsDNA vanish as dsDNA extends from a helical form to a zipper form while it is transported through the nanopore. The predicted ability to detect conformational changes in dsDNA via transverse electronic conductance can widen the potential use of graphene-based nanosensors for DNA detection.
机译:通过强制延伸对DNA进行机械操作可导致双链DNA(dsDNA)在结构上从螺旋形式转变为线性拉链状形式。通过采用经典的分子动力学和基于量子力学非平衡格林函数的基于输运的模拟,我们证明了石墨烯纳米孔具有能力,可以利用横向电子电导,在从螺旋到拉链的过渡过程中识别不同的dsDNA构象。特别地,当dsDNA从螺旋形式延伸到拉链形式时,由于螺旋dsDNA引起的电导振荡消失,而dsDNA则通过纳米孔运输。通过横向电子电导检测dsDNA构象变化的预期能力可以拓宽基于石墨烯的纳米传感器在DNA检测中的潜在用途。

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