Jendrejack Richard M, Dimalanta Eileen T, Schwartz David C, Graham Michael D, de Pablo Juan J
Department of Chemical and Biological Engineering, University of Wisconsin-Madison, Madison, Wisconsin 53706, USA.
Phys Rev Lett. 2003 Jul 18;91(3):038102. doi: 10.1103/PhysRevLett.91.038102. Epub 2003 Jul 15.
An extended Brownian dynamics simulation method is used to characterize the dynamics of long DNA molecules flowing in microchannels. The relaxation time increases due to confinement in agreement with scaling predictions. During flow the molecules migrate toward the channel center line, and thereby segregate according to molecular weight. Capturing these effects requires the detailed incorporation of solvent flow in the simulation method, demonstrating the importance of hydrodynamic effects in the dynamics of confined macromolecules.
一种扩展的布朗动力学模拟方法被用于表征在微通道中流动的长DNA分子的动力学。由于受限,弛豫时间增加,这与标度预测一致。在流动过程中,分子向通道中心线迁移,从而根据分子量进行分离。要捕捉这些效应,需要在模拟方法中详细纳入溶剂流,这表明了流体动力学效应在受限大分子动力学中的重要性。