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A Markov state model is a powerful tool that can be used to track the evolution of populations of configurations in an atomistic representation of a protein. For a coarse-grained linear chain model with discontinuous interactions, the…

软凝聚态物质 · 物理学 2024-02-06 Margarita Colberg , Jeremy Schofield

Discrete diffusion has recently emerged as a promising paradigm in discrete data modeling. However, existing methods typically rely on a fixed rate transition matrix during training, which not only limits the expressiveness of latent…

机器学习 · 计算机科学 2025-05-27 Hengli Li , Yuxuan Wang , Song-Chun Zhu , Ying Nian Wu , Zilong Zheng

We present a channel-constrained Markovian quantum diffusion (CCMQD) model that prepares quantum states by rigorously framing the generative process within the dynamics of open quantum systems. Our model interprets the forward diffusion…

量子物理 · 物理学 2025-11-18 Qin-Sheng Zhu , Geng Chen , Lian-Hui Yu , Xiaodong Xing , Xiao-Yu Li

Diffusion models (DMs) have achieved remarkable success across various domains owing to their strong generative and denoising capabilities. Meanwhile, semantic communication based on neural joint source-channel coding (JSCC) has emerged as…

信号处理 · 电气工程与系统科学 2026-03-25 Yoon Huh , Jeongho Kang , Wan Choi

In this paper, we consider a diffusive mobile molecular communication (MC) system consisting of a pair of mobile transmitter and receiver nano-machines suspended in a fluid medium, where we model the mobility of the nano-machines by…

信息论 · 计算机科学 2017-04-24 Arman Ahmadzadeh , Vahid Jamali , Robert Schober

Molecular simulations can provide microscopic insight into the physical and chemical driving forces of complex molecular processes. Despite continued advancement of simulation methodology, model errors may lead to inconsistencies between…

化学物理 · 物理学 2016-02-12 Joseph F. Rudzinski , Kurt Kremer , Tristan Bereau

Diffusion processes are instrumental to describe the movement of a continuous quantity in a generic network of interacting agents. Here, we present a probabilistic framework for diffusion in networks and propose to classify agent…

社会与信息网络 · 计算机科学 2015-08-28 Wai Hong Ronald Chan , Matthias Wildemeersch , Tony Q. S. Quek

Probabilistic generative models based on measure transport, such as diffusion and flow-based models, are often formulated in the language of Markovian stochastic dynamics, where the choice of the underlying process impacts both algorithmic…

机器学习 · 计算机科学 2026-04-06 Yinuo Ren , Grant M. Rotskoff , Lexing Ying

In this paper, we propose an end-to-end channel model for molecular communication systems with metal-oxide sensors. In particular, we focus on the recently developed table top molecular communication platform. The system is separated into…

新兴技术 · 计算机科学 2015-03-11 Na-Rae Kim , Nariman Farsad , Chan-Byoung Chae , Andrew W. Eckford

By considering potential health problems that a fully covering receiver may cause in vessel-like environments, the implementation of a partially covering receiver is needed. To this end, distribution of hitting location of messenger…

新兴技术 · 计算机科学 2018-02-06 Meriç Turan , Mehmet Sukru Kuran , H. Birkan Yilmaz , Ilker Demirkol , Tuna Tugcu

We consider molecular communication networks consisting of transmitters and receivers distributed in a fluidic medium. In such networks, a transmitter sends one or more signalling molecules, which are diffused over the medium, to the…

计算工程、金融与科学 · 计算机科学 2015-03-20 Chun Tung Chou

The derivation of suitable analytical models is an important step for the design and analysis of molecular communication systems. However, many existing models have limited applicability in practical scenarios due to various simplifications…

新兴技术 · 计算机科学 2019-11-28 Maximilian Schäfer , Wayan Wicke , Werner Haselmayr , Rudolf Rabenstein , Robert Schober

This work presents algebraic closure models associated with advective transport and nonlinear reactions in a Reynolds-averaged Navier-Stokes context for a system of species subject to binary reactions and transport by advection and…

流体动力学 · 物理学 2021-11-29 Omkar B. Shende , Ali Mani

We propose and analyse a model predictive control (MPC) strategy tailored for networks of underwater agents tasked with maintaining formation while following a shared path and using acoustic communication channels. The strategy accommodates…

最优化与控制 · 数学 2024-10-22 Emil Wengle , Damiano Varagnolo

Mathematically modeling complex transport phenomena at the molecular level can be a powerful tool for identifying transport mechanisms and predicting macroscopic properties. We use two different stochastic time series models, parameterized…

软凝聚态物质 · 物理学 2020-09-11 Benjamin J. Coscia , Michael R. Shirts

Reaction-diffusion systems have been proposed as a model for pattern formation and morphogenesis. The Fickian diffusion typically employed in these constructions model the Brownian motion of particles. The biological and chemical elements…

定量方法 · 定量生物学 2023-11-09 Siddhartha Srivastava , Krishna Garikipati

This paper proposes a control theoretic framework to model and analyze the self-organized pattern formation of molecular concentrations in biomolecular communication networks, emerging applications in synthetic biology. In biomolecular…

分子网络 · 定量生物学 2019-01-08 Yutaka Hori , Hiroki Miyazako , Soichiro Kumagai , Shinji Hara

Many complex systems have natural representations as multi-layer networks. While these formulations retain more information than standard single-layer network models, there is not yet a fully developed theory for computing network metrics…

社会与信息网络 · 计算机科学 2017-03-17 Daryl R. DeFord , Scott D. Pauls

Diffusions are a fundamental class of models in many fields, including finance, engineering, and biology. Simulating diffusions is challenging as their sample paths are infinite-dimensional and their transition functions are typically…

统计方法学 · 统计学 2021-06-11 Paul A. Jenkins , Murray Pollock , Gareth O. Roberts , Michael Sørensen

This paper develops a tractable analytical channel model for first-hitting-time molecular communication (MC) systems under time-varying drift. While existing studies of nonstationary transport rely primarily on numerical solutions of…

信息论 · 计算机科学 2026-03-30 Yen-Chi Lee