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We develop a new numerical method for approximating the infinite time reachable set of strictly stable linear control systems. By solving a linear program with a constraint that incorporates the system dynamics, we compute a polytope with…

Optimization and Control · Mathematics 2019-04-03 Andreas Ernst , Lars Grüne , Janosch Rieger

Polymers are a vital part of everyday life. Their chemical universe is so large that it presents unprecedented opportunities as well as significant challenges to identify suitable application-specific candidates. We present a complete…

Materials Science · Physics 2023-07-20 Christopher Kuenneth , Rampi Ramprasad

Across many disciplines, chemical reaction networks (CRNs) are an established population model defined as a system of coupled nonlinear ordinary differential equations. In many applications, for example, in systems biology and epidemiology,…

Systems and Control · Electrical Eng. & Systems 2023-01-23 Kim G. Larsen , Daniele Toller , Mirco Tribastone , Max Tschaikowski , Andrea Vandin

We identify and demonstrate a weakness of Petri Nets (PN) in specifying composite behavior of reactive systems. Specifically, we show how, when specifying multiple requirements in one PN model, modelers are obliged to specify mechanisms for…

Software Engineering · Computer Science 2023-04-20 Achiya Elyasaf , Tom Yaacov , Gera Weiss

A fundamental question in systems biology is what combinations of mean and variance of the species present in a stochastic biochemical reaction network are attainable by perturbing the system with an external signal. To address this…

Systems and Control · Computer Science 2017-05-02 Francesca Parise , Maria Elena Valcher , John Lygeros

The categorical modeling of Petri nets has received much attention recently. The Dialectica construction has also had its fair share of attention. We revisit the use of the Dialectica construction as a categorical model for Petri nets…

Category Theory · Mathematics 2025-12-24 Elena Di Lavore , Wilmer Leal , Valeria de Paiva

Machine Learning techniques can be used to represent high-dimensional potential energy surfaces for reactive chemical systems. Two such methods are based on a reproducing kernel Hilbert space representation or on deep neural networks. They…

Chemical Physics · Physics 2019-09-19 Oliver T. Unke , Markus Meuwly

In chemical reaction network theory, ordinary differential equations are used to model the temporal change of chemical species concentration. As the functional form of these ordinary differential equations systems is derived from an…

Molecular Networks · Quantitative Biology 2025-02-27 Anna C. M. Thöni , William E. Robinson , Yoram Bachrach , Wilhelm T. S. Huck , Tal Kachman

The core of molecular dynamics simulation fundamentally lies in the interatomic potential. Traditional empirical potentials lack accuracy, while first-principles methods are computationally prohibitive. Machine learning interatomic…

Machine Learning · Computer Science 2026-03-25 Shuyu Bi , Zhede Zhao , Qiangchao Sun , Tao Hu , Xionggang Lu , Hongwei Cheng

Modelling, specifying and reasoning about complex systems requires to process in an integrated fashion declarative and procedural aspects of the target domain. The paper reports on an experiment conducted with a propositional version of…

Artificial Intelligence · Computer Science 2020-08-04 Giovanni Sileno

The matrix element method utilizes ab initio calculations of probability densities as powerful discriminants for processes of interest in experimental particle physics. The method has already been used successfully at previous and current…

Computational Physics · Physics 2015-05-20 Doug Schouten , Adam DeAbreu , Bernd Stelzer

Place/transition Petri nets are a standard model for a class of distributed systems whose reachability spaces might be infinite. One of well-studied topics is the verification of safety and liveness properties in this model; despite the…

Logic in Computer Science · Computer Science 2016-08-09 Petr Jancar

Biochemical networks are used in computational biology, to model the static and dynamical details of systems involved in cell signaling, metabolism, and regulation of gene expression. Parametric and structural uncertainty, as well as…

Molecular Networks · Quantitative Biology 2014-10-15 Ovidiu Radulescu , Alexander N. Gorban , Andrei Zinovyev , Vincent Noel

Most existing process discovery techniques aim to mine models of process orchestrations that represent behavior of cases within one business process. Collaboration process discovery techniques mine models of collaboration processes that…

Formal Languages and Automata Theory · Computer Science 2024-10-11 Janik-Vasily Benzin , Stefanie Rinderle-Ma

In this paper we study Hornets extended with firing probabilities. Hornets are a Nets-within-Nets formalism, i.e., a Petri net formalism where the tokens are Petri nets again. Each of these net-tokens has its own firing rate, independent…

Logic in Computer Science · Computer Science 2024-11-19 Michael Köhler-Bußmeier

A reaction network is a chemical system involving multiple reactions and chemical species. Stochastic models of such networks treat the system as a continuous time Markov chain on the number of molecules of each species with reactions as…

Probability · Mathematics 2007-05-23 Karen Ball , Thomas G. Kurtz , Lea Popovic , Greg Rempala

A basic model in sequential decision making is the Markov decision process (MDP), which is extended to Robust MDPs (RMDPs) by allowing uncertainty in transition probabilities and optimizing against the worst-case transition probabilities…

Computational Complexity · Computer Science 2026-05-11 Ali Asadi , Krishnendu Chatterjee , Alipasha Montaseri , Ali Shafiee

We consider Dense-Timed Petri Nets (TPN), an extension of Petri nets in which each token is equipped with a real-valued clock and where the semantics is lazy (i.e., enabled transitions need not fire; time can pass and disable transitions).…

Logic in Computer Science · Computer Science 2017-01-11 Parosh Abdulla , Pritha Mahata , Richard Mayr

Partial Differential Equations are infinite dimensional encoded representations of physical processes. However, imbibing multiple observation data towards a coupled representation presents significant challenges. We present a fully…

Machine Learning · Computer Science 2020-03-09 Gurpreet Singh , Soumyajit Gupta , Matt Lease , Clint N. Dawson

Automated synthesis from behavioural specifications is an attractive and powerful way of constructing concurrent systems. Here we focus on the problem of synthesising a membrane system from a behavioural specification given in the form of a…

Logic in Computer Science · Computer Science 2012-11-20 Jetty Kleijn , Maciej Koutny , Marta Pietkiewicz-Koutny , Grzegorz Rozenberg