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A novel combination of discontinuous molecular dynamics and the Langevin equation, together with an intermediate-resolution model, are used to carry out long (several $\mu$s) simulation and study folding transition and transport of proteins…

软凝聚态物质 · 物理学 2011-11-09 Leili Javidpour , Muhammad Sahimi , M. Reza Rahimi Tabar

The dynamics of motor protein molecules that have two subunits is investigated using simple discrete stochastic models. Exact steady-state analytical expressions are obtained for velocities and dispersions for any number of intermediate…

软凝聚态物质 · 物理学 2015-06-25 Anatoly B. Kolomeisky , Hubert Phillips

Diffusive motion of regulatory enzymes on biopolymers with eventual capture at a reaction site is a common feature in cell biology. Using a lattice gas model we study the impact of diffusion and capture for a microtubule polymerase and a…

生物物理 · 物理学 2016-08-12 Emanuel Reithmann , Louis Reese , Erwin Frey

Using field theoretic renormalization group methods we study the critical behavior of a driven diffusive system near a boundary perpendicular to the driving force. The boundary acts as a particle reservoir which is necessary to maintain the…

统计力学 · 物理学 2009-10-31 K. Oerding , H. K. Janssen

The growing interest for comparing protein internal dynamics owes much to the realization that protein function can be accompanied or assisted by structural fluctuations and conformational changes. Analogously to the case of functional…

生物大分子 · 定量生物学 2012-12-19 C. Micheletti

Many signalling functions in molecular biology require proteins bind to substrates such as DNA in response to environmental signals such as the simultaneous binding to a small molecule. Examples are repressor proteins which may transmit…

生物大分子 · 定量生物学 2009-11-10 Rhoda J. Hawkins , Thomas C. B. McLeish

We study the movement of the living organism in a band form towards the presence of chemical substrates based on a system of partial differential evolution equations. We incorporate Einstein's method of Brownian motion to deduce the…

偏微分方程分析 · 数学 2023-10-10 Rahnuma Islam , Akif Ibragimov

A novel mechanism of reaction-induced active molecular motion, not involving any kind of self-propulsion, is proposed and analyzed. Because of the momentum exchange with the surrounding solvent, conformational transitions in…

软凝聚态物质 · 物理学 2023-04-19 Hiroyuki Kitahata , Alexander S. Mikhailov

Coarse-graining is central to reducing dimensionality in molecular dynamics, and is typically characterized by a mapping which projects the full state of the system to a smaller class of variables. While extensive literature has been…

概率论 · 数学 2020-01-08 Frédéric Legoll , Tony Lelièvre , Upanshu Sharma

We consider the hydrodynamics of lipid bilayers containing transmembrane proteins of arbitrary shape. This biologically-motivated problem is relevant to the cell membrane, whose fluctuating dynamics play a key role in phenomena ranging from…

软凝聚态物质 · 物理学 2016-10-10 Andrew Callan-Jones , Marc Durand , Jean-Baptiste Fournier

The Escherichia coli chemotaxis signaling pathway has served as a model system for studying the adaptive sensing of environmental signals by large protein complexes. The chemoreceptors control the kinase activity of CheA in response to the…

生物物理 · 物理学 2023-10-16 David Hathcock , Qiwei Yu , Bernardo A. Mello , Divya N. Amin , Gerald L. Hazelbauer , Yuhai Tu

Many transport processes in nature take place on substrates, often considered as unidimensional lanes. These unidimensional substrates are typically non-static: affected by a fluctuating environment, they can undergo conformational changes.…

Directional chemosensing is ubiquitous in cell biology, but some cells such as mating yeast paradoxically degrade the signal they aim to detect. While the data processing inequality suggests that such signal modification cannot increase the…

生物物理 · 物理学 2023-10-04 Ryan LeFebre , Joseph A. Landsittel , David E. Stone , Andrew Mugler

Recent experiments have revealed that the diffusivity of exothermic and fast enzymes is enhanced when they are catalytically active, and different physical mechanisms have been explored and quantified to account for this observation. We…

生物物理 · 物理学 2017-08-02 Pierre Illien , Xi Zhao , Krishna K. Dey , Peter J. Butler , Ayusman Sen , Ramin Golestanian

A novel energy landscape model, ELM, for proteins recently explained a collection of incoherent, elastic neutron scattering data from proteins. The ELM of proteins considers the elastic response of the proton and its environment to the…

生物物理 · 物理学 2018-01-08 Robert D. Young

Chemotaxis is a ubiquitous biological phenomenon in which cells detect a spatial gradient of chemoattractant, and then move towards the source. Here we present a position-dependent advection-diffusion model that quantitatively describes the…

生物物理 · 物理学 2018-04-06 Zahra Eidi , Farshid Mohammad-Rafiee , Mohammad Khorrami , Azam Gholami

Active matter systems comprise self-propelled particles that move on a substrate while leaving chemical trails that influence other particles through chemotaxis (e.g., slime-depositing bacteria). Orientational chemotaxis manifests as a…

软凝聚态物质 · 物理学 2025-12-11 Aymeric Lutier , Frédéric van Wijland , Jean-Baptiste Fournier

The diffusion-controlled limit of reaction times for site-specific DNA-binding proteins is derived from first principles. We follow the generally accepted concept that a protein propagates via two competitive modes, a three-dimensional…

生物物理 · 物理学 2009-11-11 Konstantin V. Klenin , Holger Merlitz , Joerg Langowski , Chen-Xu Wu

Recent experiments by Y. Gambin et al. [PNAS 103, 2098 (2006)] have called into question the applicability of the Saffman-Delbruck diffusivity for proteins embedded in the lipid bilayers. We present a simple argument to account for this…

软凝聚态物质 · 物理学 2009-11-13 Ali Naji , Alex J. Levine , Philip A. Pincus

Engineering molecular systems that exhibit complex behavior requires the design of kinetic barriers. For example, an effective catalytic pathway must have a large barrier when the catalyst is absent. While programming such energy barriers…

新兴技术 · 计算机科学 2020-01-28 Keenan Breik , Cameron Chalk , David Doty , David Haley , David Soloveichik