Coarse Graining DNA: Symmetry, Nonlocal Elasticity, and Persistence Length

Yair Augusto Gutierrez Fosado*, Fabio Landuzzi, Takahiro Sakaue

*Corresponding author for this work

Research output: Contribution to journalArticlepeer-review

Abstract

While the behavior of double-stranded DNA at mesoscopic scales is fairly well understood, less is known about its relation to the rich mechanical properties in the base-pair scale, which is crucial, for instance, to understand DNA-protein interactions and the nucleosome diffusion mechanism. Here, by employing the rigid base-pair model, we connect its microscopic parameters to the persistence length. Combined with all-atom molecular dynamic simulations, our scheme identifies relevant couplings between different degrees of freedom at each coarse-graining step. This allows us to clarify how the scale dependence of the elastic moduli is determined in a systematic way encompassing the role of previously unnoticed off-site couplings between deformations with different parity.
Original languageEnglish
Article number058402
Pages (from-to)1-6
Number of pages6
JournalPhysical Review Letters
Volume130
Issue number5
DOIs
Publication statusPublished - 3 Feb 2023

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