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We propose a formalism for deriving force-elongation and elongation-force relations for flexible chain molecules from analytical expressions for their radial distribution function, which provides insight into the factors controlling the…

Soft Condensed Matter · Physics 2021-02-03 Ralf Everaers , Nils B. Becker , Angelo Rosa

We used high-resolution quasielastic neutron scattering spectroscopy to study the single-particle dynamics of water molecules on the surface of hydrated DNA samples. Both H2O and D2O hydrated samples were measured. The contribution of…

The effects of sampling rate and total measurement time have been determined for single-point measurements of step fluctuations within the context of first-passage properties. Time dependent STM has been used to evaluate step fluctuations…

Statistical Mechanics · Physics 2007-05-23 D. B. Dougherty , C. Tao , O. Bondarchuk , W. G. Cullen , E. D. Williams , M. Constantin , C. Dasgupta , S. Das Sarma

In mechanical manipulation experiments, a single DNA molecule overwound at constant force undergoes a discontinuous drop in extension as it buckles and forms a superhelical loop (a plectoneme). Further overwinding the DNA, we observe an…

Biological Physics · Physics 2018-04-23 Andrew Dittmore , Keir C. Neuman

Exact numerical methods and stochastic simulation methods are developed to study the force stretching single RNA issue on the secondary structure level in equilibrium. By computing the force-extension curves on the constant force and the…

Biomolecules · Quantitative Biology 2016-09-08 Fei Liu , Bi-hui Zhu , Zhong-can Ou-Yang

We study the three-dimensional persistent random walk with drift. Then we develop a thermodynamic model that is based on this random walk without assuming the Boltzmann-Gibbs form for the equilibrium distribution. The simplicity of the…

Statistical Mechanics · Physics 2009-11-13 Erik Van der Straeten , Jan Naudts

We present a new method for calculating internal forces in DNA structures using coarse-grained models and demonstrate its utility with the oxDNA model. The instantaneous forces on individual nucleotides are explored and related to model…

Soft Condensed Matter · Physics 2021-03-10 Megan C. Engel , Flavio Romano , Ard A. Louis , Jonathan P. K. Doye

We present a model supported by simulation to explain the effect of temperature on the conduction threshold in disordered systems. Arrays with randomly distributed local thresholds for conduction occur in systems ranging from…

Disordered Systems and Neural Networks · Physics 2007-05-23 Klara Elteto , Eduard G. Antonyan , T. T. Nguyen , Heinrich M. Jaeger

Single-molecule force-extension experiments have allowed quantitative measurements of the mechanical responses of biomolecules to applied forces explaining their roles in key biological functions. Electrophoretic stretching of charged…

Soft Condensed Matter · Physics 2024-02-21 Ananya Mondal , Greg Morrison

Near the melting transition the bending elastic constant, $\kappa$, an emergent property of double-stranded DNA (dsDNA), is shown not to follow the rod-like scaling for small length $N$. The reduction in $\kappa$ with temperature is…

Soft Condensed Matter · Physics 2020-11-12 Debjyoti Majumdar , Somendra M. Bhattacharjee

Single molecule force spectroscopy reveals unfolding of domains in titin upon stretching. We provide a theoretical framework for these experiments by computing the phase diagrams for force-induced unfolding of single domain proteins using…

Soft Condensed Matter · Physics 2009-10-31 D. K. Klimov , D. Thirumalai

The mechanical characteristics of fibers (of various materials), as well as of fiber bundles, are of primary importance for the design and the mechanical behavior of textiles, or of fibrous and composite materials. These characteristics are…

Soft Condensed Matter · Physics 2026-03-17 Jerome Weiss

We use the recently introduced small-world networks (SWN) to model cross-linked polymers, as an extension of the linear Rouse-chain. We study the SWN-dynamics under the influence of external forces. Our focus is on the structurally and…

Statistical Mechanics · Physics 2009-10-31 S. Jespersen , I. M. Sokolov , A. Blumen

Using coarse-grained model we have explored forced-unfolding of RNA hairpin as a function of $f_S$ and the loading rate ($r_f$). The simulations and theoretical analysis have been done without and with the handles that are explicitly…

Biomolecules · Quantitative Biology 2009-11-13 Changbong Hyeon , D. Thirumalai

We study the magnetization dynamics in nanomagnets excited by stochastic magnetic fields to mimic temperature in a micromagnetic framework. The effect of confinement arising from the finite size of the structures is investigated, and we…

Mesoscale and Nanoscale Physics · Physics 2021-04-09 Samuel D. Slöetjes , Björgvin Hjörvarsson , Vassilios Kapaklis

Effect of molecular crowding and confinement experienced by protein in the cell during unfolding has been studied by modeling a linear polymer chain on a percolation cluster. It is known that internal structure of the cell changes in time,…

Soft Condensed Matter · Physics 2015-05-14 Amit Raj Singh , Debaprasad Giri , Sanjay Kumar

We construct a theoretical model for the dynamics of a microscale colloidal particle, modeled as an interval, moving horizontally on a DNA-coated surface, modelled as a line coated with springs that can stick to the interval. Averaging over…

Soft Condensed Matter · Physics 2018-09-28 James P. Lee-Thorp , Miranda Holmes-Cerfon

We explore in detail the structural, mechanical and thermodynamic properties of a coarse-grained model of DNA similar to that introduced in Thomas E. Ouldridge, Ard A. Louis, Jonathan P.K. Doye, Phys. Rev. Lett. 104 178101 (2010). Effective…

Biomolecules · Quantitative Biology 2013-06-25 Thomas E. Ouldridge , Ard A. Louis , Jonathan P. K. Doye

Base stacking is crucial in nucleic acid stabilization, from DNA duplex hybridization to single-stranded DNA (ssDNA) protein binding. While stacking energies are tiny in ssDNA, they are inextricably mixed with hydrogen bonding in DNA base…

Soft Condensed Matter · Physics 2024-11-19 Xavier Viader-Godoy , Maria Manosas , Felix Ritort

We theoretically study the molecular-weight dependence of DNA thermophoresis, which arises from mutual advection of the n repeat units of the molecular chain. As a main result we find that the dominant driving forces, i.e., the thermally…

Soft Condensed Matter · Physics 2018-02-01 Aboubakry Ly , Aloïs Würger