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The concept of the limiting step is extended to the asymptotology of multiscale reaction networks. Complete theory for linear networks with well separated reaction rate constants is developed. We present algorithms for explicit…

Chemical Physics · Physics 2010-06-15 A. N. Gorban , O. Radulescu , A. Y. Zinovyev

Background: A classical problem in metabolic design is to maximize the production of desired compound in a given chemical reaction network by appropriately directing the mass flow through the network. Computationally, this problem is…

Molecular Networks · Quantitative Biology 2011-10-28 Jakob L. Andersen , Christoph Flamm , Daniel Merkle , Peter F. Stadler

The analysis of the structure of chemical reaction networks is crucial for a better understanding of chemical processes. Such networks are well described as hypergraphs. However, due to the available methods, analyses regarding network…

Computational Complexity · Computer Science 2013-09-30 Rolf Fagerberg , Christoph Flamm , Daniel Merkle , Philipp Peters , Peter F. Stadler

This paper deals with the CREP (Configuration REachability Problem) for non-uniform cellular automata (CAs). The cells of non-uniform CAs, we have considered here, can use different Wolfram's rules to generate their next states. We report…

Computational Complexity · Computer Science 2019-01-25 Sumit Adak , Sukanya Mukherjee , Sukanta Das

The exploration of pathways and alternative pathways that have a specific function is of interest in numerous chemical contexts. A framework for specifying and searching for pathways has previously been developed, but a focus on which of…

Molecular Networks · Quantitative Biology 2024-12-23 Jakob L. Andersen , Sissel Banke , Rolf Fagerberg , Christoph Flamm , Daniel Merkle , Peter F. Stadler

Stochastic Chemical Reaction Networks are continuous time Markov chain models that describe the time evolution of the molecular counts of species interacting stochastically via discrete reactions. Such models are ubiquitous in systems and…

Quantitative Methods · Quantitative Biology 2024-02-01 Theodore W. Grunberg , Domitilla Del Vecchio

Temporal networks are a class of time-varying networks, which change their topology according to a given time-ordered sequence of static networks (known as subsystems). This paper investigates the reachability and controllability of…

Systems and Control · Electrical Eng. & Systems 2024-05-27 Yuan Zhang , Yuanqing Xia , Long Wang

Designed as extremely deep architectures, deep residual networks which provide a rich visual representation and offer robust convergence behaviors have recently achieved exceptional performance in numerous computer vision problems. Being…

Computer Vision and Pattern Recognition · Computer Science 2017-04-13 T. Hoang Ngan Le , Chi Nhan Duong , Ligong Han , Khoa Luu , Marios Savvides , Dipan Pal

Complex-valued neural networks have attracted increasing attention in recent years, while it remains open on the advantages of complex-valued neural networks in comparison with real-valued networks. This work takes one step on this…

Machine Learning · Computer Science 2022-07-04 Shao-Qun Zhang , Wei Gao , Zhi-Hua Zhou

Growth and decay are system-level properties of chemical reaction networks (CRNs) relevant from prebiotic chemistry to cellular metabolism. Their properties are typically analyzed through the kinetics of particular models, which requires…

Molecular Networks · Quantitative Biology 2026-03-31 Praful Gagrani , Jiwei Wang , Yannick De Decker , David Lacoste

A decomposition of a chemical reaction network (CRN) is produced by partitioning its set of reactions. The partition induces networks, called subnetworks, that are "smaller" than the given CRN which, at this point, can be called parent…

Molecular Networks · Quantitative Biology 2021-09-15 Lauro L. Fontanil , Eduardo R. Mendoza

Similarly to gear systems in vehicles, most chemical reaction networks (CRNs) involved in energy transduction have at their disposal multiple transduction pathways, each characterized by distinct efficiencies. We conceptualize these…

Molecular Networks · Quantitative Biology 2025-07-24 Massimo Bilancioni , Massimiliano Esposito

Exploring large chemical reaction networks with automated exploration approaches and accurate quantum chemical methods can require prohibitively large computational resources. Here, we present an automated exploration approach that focuses…

Chemical Physics · Physics 2024-06-12 Moritz Bensberg , Markus Reiher

The security of mobile robotic networks (MRNs) has been an active research topic in recent years. This paper demonstrates that the observable interaction process of MRNs under formation control will present increasingly severe threats.…

Systems and Control · Electrical Eng. & Systems 2021-06-07 Yushan Li , Jianping He , Xuda Ding , Lin Cai , Xinping Guan

In this paper we study a class of stochastic chemical reaction networks (CRNs) for which chemical species are created by a sequence of chain reactions. We prove that under some convenient conditions on the initial state, some of these…

Probability · Mathematics 2024-06-19 Lucie Laurence , Philippe Robert

Route Recommendation (RR) is a core task in route planning within online navigation applications, aiming to recommend the optimal route among candidate routes to users. Industrially, RR adopts the two-stage recall-and-rank framework instead…

Information Retrieval · Computer Science 2026-02-04 Hanyu Guo , Chao Chen , Longfei Xu , Chengzhang Wang , Kaikui Liu , Xiangxiang Chu

The use of mathematical models has helped to shed light on countless phenomena in chemistry and biology. Often, though, one finds that systems of interest in these fields are dauntingly complex. In this paper, we attempt to synthesize and…

Molecular Networks · Quantitative Biology 2007-09-04 Mark Lipson

We present a framework to transform the problem of finding a Lyapunov function of a Chemical Reaction Network (CRN) in concentration coordinates with arbitrary monotone kinetics into finding a common Lyapunov function for a linear parameter…

Optimization and Control · Mathematics 2017-10-31 M. Ali Al-Radhawi , David Angeli

This paper presents novel decomposition classes of chemical reaction networks (CRNs) derived from S-system kinetics. Based on the network decomposition theory initiated by Feinberg in 1987, we introduce the concept of incidence independent…

Dynamical Systems · Mathematics 2020-03-04 Honeylou F. Farinas , Eduardo R. Mendoza , Angelyn R. Lao

We address a fundamental problem in chemistry known as chemical reaction product prediction. Our main insight is that the input reactant and reagent molecules can be jointly represented as a graph, and the process of generating product…

Neural and Evolutionary Computing · Computer Science 2018-12-27 Kien Do , Truyen Tran , Svetha Venkatesh