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We establish universal relations between pattern formation and dissipation with a geometric approach to nonequilibrium thermodynamics of deterministic reaction-diffusion systems. We first provide a way to systematically decompose the…

统计力学 · 物理学 2026-05-04 Ryuna Nagayama , Kohei Yoshimura , Artemy Kolchinsky , Sosuke Ito

The analysis of non-equilibrium steady states of biochemical reaction networks relies on finding the configurations of fluxes and chemical potentials satisfying stoichiometric (mass balance) and thermodynamic (energy balance) constraints.…

分子网络 · 定量生物学 2011-07-13 Daniele De Martino , Matteo Figliuzzi , Andrea De Martino , Enzo Marinari

Chemical reaction networks (CRN) comprise an important class of models to understand biological functions such as cellular information processing, the robustness and control of metabolic pathways, circadian rhythms, and many more. However,…

分子网络 · 定量生物学 2025-03-25 Dimitri Loutchko , Yuki Sughiyama , Tetsuya J. Kobayashi

The catalytic reaction system (CRS) formalism by Hordijk and Steel is a versatile method to model autocatalytic biochemical reaction networks. It is particularly suited, and has been widely used, to study self-sustainment and…

分子网络 · 定量生物学 2023-08-16 Dimitri Loutchko

Coupled chemical interactions in a well-mixed solution are commonly formalized as chemical reaction networks (CRNs). However, despite the widespread use of CRNs in the natural sciences, the range of computational behaviors exhibited by CRNs…

新兴技术 · 计算机科学 2023-04-11 Ho-Lin Chen , David Doty , Wyatt Reeves , David Soloveichik

A nonperturbative electron transfer rate theory is developed based on the reduced density matrix dynamics, which can be evaluated readily for the Debye solvent model without further approximation. Not only does it recover for reaction rates…

量子物理 · 物理学 2007-05-23 Ping Han , Rui-Xue Xu , Baiqing Li , Jian Xu , Ping Cui , Yan Mo , YiJing Yan

We introduce an infinite particle system dynamics, which includes stochastic chemical kinetics models, the classical Kac model and free space movement. We study energy redistribution between two energy types (kinetic and chemical) in…

数学物理 · 物理学 2015-06-03 V. A. Malyshev

In the past the study of reaction-diffusion systems has greatly contributed to our understanding of the behavior of many-body systems far from equilibrium. In this paper we aim at characterizing the properties of diffusion limited reactions…

统计力学 · 物理学 2015-05-14 Sven Dorosz , Michel Pleimling

Reaction-diffusion systems, which consist of the reacting particles subject to diffusion process, constitute one of the common examples of non-linear statistical systems. In low space dimensions $d \leq 2$ the usual description by means of…

统计力学 · 物理学 2023-10-24 Michal Hnatič , Matej Kecer , Tomáš Lučivjanský

Large time dynamics of reaction-diffusion systems modeling some irreversible reaction networks are investigated. Depending on initial masses, these networks possibly possess boundary equilibria, where some of the chemical concentrations are…

偏微分方程分析 · 数学 2024-11-04 Thi Lien Nguyen , Bao Quoc Tang

Biochemical reactions are fundamentally noisy at a molecular scale. This limits the precision of reaction networks, but also allows fluctuation measurements which may reveal the structure and dynamics of the underlying biochemical network.…

生物物理 · 物理学 2018-04-11 Harmen Wierenga , Pieter Rein ten Wolde , Nils B. Becker

The reaction mechanisms of the two-neutron transfer reaction $^{12}$C($^6$He,$^4$He) have been studied at 30 MeV at the TRIUMF ISAC-II facility using the SHARC charged-particle detector array. Optical potential parameters have been…

Long-term behaviors of biochemical systems are described by steady states in deterministic models and stationary distributions in stochastic models. Obtaining their analytic solutions can be done for limited cases, such as linear or…

分子网络 · 定量生物学 2022-12-05 Hyukpyo Hong , Bryan S. Hernandez , Jinsu Kim , Jae Kyoung Kim

The competition among reaction processes of a weakly-bound projectile at intermediate times of a slow collision has been unraveled. This has been done using a two-center molecular continuum within a semiclassical, time-dependent…

核理论 · 物理学 2021-07-14 Laura Moschini , Alexis Diaz-Torres

Stochastic line integrals provide a useful tool for quantitatively characterizing irreversibility and detailed balance violation in noise-driven dynamical systems. A particular realization is the stochastic area, recently studied in coupled…

统计力学 · 物理学 2022-09-14 Stephen Teitsworth , John Neu

Continuous-time Markov chains are used to model stochastic systems where transitions can occur at irregular times, e.g., birth-death processes, chemical reaction networks, population dynamics, and gene regulatory networks. We develop a…

机器学习 · 统计学 2022-12-13 Majerle Reeves , Harish S. Bhat

Which reaction networks, when taken with mass-action kinetics, have the capacity for multiple steady states? There is no complete answer to this question, but over the last 40 years various criteria have been developed that can answer this…

动力系统 · 数学 2015-08-21 Badal Joshi , Anne Shiu

We study a simplified, solvable model of a fully-connected metabolic network with constrained quenched disorder to mimic the conservation laws imposed by stoichiometry on chemical reactions. Within a spin-glass type of approach, we show…

分子网络 · 定量生物学 2008-10-30 Andrea De Martino , Carlotta Martelli , Francesco A. Massucci

A fundamental theory is presented for the mechanical response of polymer networks undergoing large deformation which seamlessly integrates statistical mechanical principles with macroscopic thermodynamic constitutive theory. Our formulation…

软凝聚态物质 · 物理学 2020-07-06 Michael R. Buche , Meredith N. Silberstein

The behavior of some stochastic chemical reaction networks is largely unaffected by slight inaccuracies in reaction rates. We formalize the robustness of state probabilities to reaction rate deviations, and describe a formal connection…

计算复杂性 · 计算机科学 2009-01-28 David Soloveichik