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相关论文: Fluctuations in the Ensemble of Reaction Pathways

200 篇论文

In stochastic resonance, a periodically forced Brownian particle in a double-well potential jumps between minima at rare increments, the prediction of which poses a major theoretical challenge. Here, we use a path-integral method to find a…

数据分析、统计与概率 · 物理学 2020-04-02 L. T. Giorgini , S. H. Lim , W. Moon , J. S. Wettlaufer

We discuss the ``soft-ratcheting'' algorithm which generates targeted stochastic trajectories in molecular systems with scores corresponding to their probabilities. The procedure, which requires no initial pathway guess, is capable of…

化学物理 · 物理学 2007-05-23 Daniel M. Zuckerman , Thomas B. Woolf

We introduce a path sampling method for obtaining statistical properties of an arbitrary stochastic dynamics. The method works by decomposing a trajectory in time, estimating the probability of satisfying a progress constraint, modifying…

统计力学 · 物理学 2015-06-04 Nicholas Guttenberg , Aaron R. Dinner , Jonathan Weare

Fluctuations in parameters that are typically treated as fixed play a crucial role in the behavior of complex systems. However, to date, we lack a general non-equilibrium thermodynamic treatment of such a complex system. In this Letter, to…

统计力学 · 物理学 2026-03-31 Tuan Pham , Deepak Gupta

In this paper, we investigate how stochastic reaction processes are affected by external perturbations. We describe an extension of the deterministic metabolic control analysis (MCA) to the stochastic regime. We introduce stochastic…

定量方法 · 定量生物学 2009-08-21 Kyung Hyuk Kim , Herbert M. Sauro

An important result in classical stochastic thermodynamics is the work fluctuation--dissipation relation (FDR), which states that the dissipated work done along a slow process is proportional to the resulting work fluctuations. Here we show…

量子物理 · 物理学 2019-12-11 Harry J. D. Miller , Matteo Scandi , Janet Anders , Martí Perarnau-Llobet

The minimum energy path (MEP) describes the mechanism of reaction, and the energy barrier along the path can be used to calculate the reaction rate in thermal systems. The nudged elastic band (NEB) method is one of the most commonly used…

数值分析 · 数学 2025-03-24 Xuanyu Liu , Huajie Chen , Christoph Ortner

In a reaction-diffusion system, fluctuations in both diffusion and reaction events, have important effects on the steady-state statistics of the system. Here, we argue through extensive lattice simulations, mean-field type arguments, and…

软凝聚态物质 · 物理学 2013-06-12 Fernando Peruani , Chiu Fan Lee

In this work the dynamics of a freely jointed random chain which fluctuates at constant temperature in some viscous medium is studied. The chain is regarded as a system of small particles which perform a brownian motion and are subjected to…

统计力学 · 物理学 2015-05-13 Franco Ferrari , Jaroslaw Paturej , Thomas A. Vilgis

A growing amount of evidence points to the fact that many enzymes exhibit fluctuations in their catalytic activity, which are associated with conformational changes on a broad range of timescales. The experimental study of this phenomenon,…

定量方法 · 定量生物学 2017-07-28 Ankit Gupta , Andreas Milias-Argeitis , Mustafa Khammash

Evaluating the linear response of a driven system to a change in environment temperature(s) is essential for understanding thermal properties of nonequilibrium systems. The system is kept in weak contact with possibly different fast…

统计力学 · 物理学 2014-12-01 Marco Baiesi , Urna Basu , Christian Maes

We are concerned with random ordinary differential equations (RODEs). Our main question of interest is how uncertainties in system parameters propagate through the possibly highly nonlinear dynamical system and affect the system's…

动力系统 · 数学 2021-08-30 Christian Kuehn , Kerstin Lux

The fluctuation-dissipation relation (FDR) links thermal fluctuations and dissipation at thermal equilibrium through temperature. Extending it beyond equilibrium conditions in pursuit of broadening thermodynamics is often feasible, albeit…

统计力学 · 物理学 2025-02-04 Dima Boriskovsky , Benjamin Lindner , Yael Roichman

Stochastic thermodynamics gives universal relations for microscopic entropy production, yet its critical behavior at macroscopic nonequilibrium transitions remains unclassified. We study well-mixed reversible chemical reaction networks in…

统计力学 · 物理学 2026-05-06 Kyota Tamano , Keiji Saito

We study the performance of a stochastic algorithm based on the power method that adaptively learns the large deviation functions characterizing the fluctuations of additive functionals of Markov processes, used in physics to model…

统计力学 · 物理学 2023-03-30 Francesco Coghi , Hugo Touchette

We introduce and study a new class of fronts in finite particle number reaction-diffusion systems, corresponding to propagating up a reaction rate gradient. We show that these systems have no traditional mean-field limit, as the nature of…

统计力学 · 物理学 2007-05-23 Elisheva Cohen , David A. Kessler , Herbert Levine

We develop stochastic mixed finite element methods for spatially adaptive simulations of fluid-structure interactions when subject to thermal fluctuations. To account for thermal fluctuations, we introduce a discrete fluctuation-dissipation…

介观与纳米尺度物理 · 物理学 2023-02-28 Pat Plunkett , Jon Hu , Chris Siefert , Paul J. Atzberger

We discuss the phenomenon of universal fluctuations in mesoscopic systems and nuclei. For this purpose we use Random Matrix Theory (RMT). The statistical $S$-matrix is used to obtain the physical observables in the case of Quantum Dots,…

介观与纳米尺度物理 · 物理学 2018-05-29 M. S. Hussein , J. G. G. S. Ramos

We study random velocity effects on a two-species reaction-diffusion system consisting of three reaction processes $A + A \rightarrow (\varnothing, A),A+B \rightarrow A$. Using the field-theoretic perturbative renormalization group we…

统计力学 · 物理学 2023-10-11 Michal Hnatič , Matej Kecer , Tomáš Lučivjanský

Maximum entropy (maxEnt) inference of state probabilities using state-dependent constraints is popular in the study of complex systems. In stochastic dynamical systems, the effect of state space topology and path-dependent constraints on…

统计力学 · 物理学 2015-10-28 Purushottam D. Dixit