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In this paper an algorithm is given to determine all possible structurally different linearly conjugate realizations of a given kinetic polynomial system. The solution is based on the iterative search for constrained dense realizations…

动力系统 · 数学 2016-03-08 Bernadett Acs , Gabor Szederkenyi , Zsolt Tuza , Zoltan Andras Tuza

Effectively modeling phenomena present in highly nonlinear dynamical systems whilst also accurately quantifying uncertainty is a challenging task, which often requires problem-specific techniques. We present a novel, domain-agnostic…

机器学习 · 统计学 2021-10-26 Thomas M. McDonald , Mauricio A. Álvarez

Accurately modeling and verifying the correct operation of systems interacting in dynamic environments is challenging. By leveraging parametric uncertainty within the model description, one can relax the requirement to describe exactly the…

最优化与控制 · 数学 2016-04-05 Patrick Holmes , Shreyas Kousik , Shankar Mohan , Ram Vasudevan

The discipline of process mining deals with analyzing execution data of operational processes, extracting models from event data, checking the conformance between event data and normative models, and enhancing all aspects of processes.…

数据结构与算法 · 计算机科学 2022-04-11 Marco Pegoraro , Merih Seran Uysal , Wil M. P. van der Aalst

Constructing uncertainty sets as unions of multiple subsets has emerged as an effective approach for creating compact and flexible uncertainty representations in data-driven robust optimization (RO). This paper focuses on two separate…

最优化与控制 · 数学 2025-02-18 Yun Li , Neil Yorke-Smith , Tamas Keviczky

Chemical kinetics and reaction engineering consists of the phenomenological framework for the disentanglement of reaction mechanisms, optimization of reaction performance and the rational design of chemical processes. Here, we utilize…

机器学习 · 计算机科学 2021-12-10 Gabriel S. Gusmão , Adhika P. Retnanto , Shashwati C. da Cunha , Andrew J. Medford

Process mining is a discipline which concerns the analysis of execution data of operational processes, the extraction of models from event data, the measurement of the conformance between event data and normative models, and the enhancement…

数据结构与算法 · 计算机科学 2022-04-09 Marco Pegoraro , Merih Seran Uysal , Wil M. P. van der Aalst

Propagating uncertainties introduced by chemical reaction rate parameters to high-fidelity numerical simulations of complex combustion devices is necessary to ascertain impact on computational predictions. However, the high cost of detailed…

计算物理 · 物理学 2026-03-12 Vansh Sharma , Shuzhi Zhang , Rahul Jain , Venkat Raman

This paper presents new results about the optimization based generation of chemical reaction networks (CRNs) of higher deficiency. Firstly, it is shown that the graph structure of the realization containing the maximal number of reactions…

分子网络 · 定量生物学 2011-03-23 Gabor Szederkenyi , Katalin M. Hangos , Tamas Peni

Accurate prediction of dynamical response of structural system depends on the correct modeling of that system. However, modeling becomes increasingly challenging when there are many candidate models available to describe the system…

应用统计 · 统计学 2025-10-06 Subhayan De , Tianhao Yu , Patrick T. Brewick , Erik A. Johnson , Steven F. Wojtkiewicz

Neural ordinary differential equations (ODEs) are an emerging class of deep learning models for dynamical systems. They are particularly useful for learning an ODE vector field from observed trajectories (i.e., inverse problems). We here…

机器学习 · 计算机科学 2023-05-23 Katharina Ott , Michael Tiemann , Philipp Hennig

This paper studies the relations among system parameters, uniqueness, and stability of equilibria, for kinetic systems given in the form of polynomial ODEs. Such models are commonly used to describe the dynamics of nonnegative systems, with…

分子网络 · 定量生物学 2016-11-14 Antonio A. Alonso , Gabor Szederkenyi

Existing procedures for model validation have been deemed inadequate for many engineering systems. The reason of this inadequacy is due to the high degree of complexity of the mechanisms that govern these systems. It is proposed in this…

人工智能 · 计算机科学 2007-05-23 A. Guergachi

Uncertainty sets are at the heart of robust optimization (RO) because they play a key role in determining the RO models' tractability, robustness, and conservativeness. Different types of uncertainty sets have been proposed that model…

最优化与控制 · 数学 2021-07-13 Meysam Cheramin , Richard Li-Yang Chen , Jianqiang Cheng , Ali Pinar

We propose a novel polyhedral uncertainty set for robust optimization, termed the smooth uncertainty set, which captures dependencies of uncertain parameters by constraining their pairwise differences. The bounds on these differences may be…

最优化与控制 · 数学 2025-10-13 Noam Goldberg , Michael Poss , Shimrit Shtern

Reconstruction of biochemical reaction networks is a central topic in systems biology which raises crucial theoretical challenges in system identification. Nonlinear Ordinary Differential Equations (ODEs) that involve polynomial and…

系统与控制 · 计算机科学 2016-11-18 Wei Pan , Ye Yuan , Guy-Bart Stan

Cataloging the complex behaviors of dynamical systems can be challenging, even when they are well-described by a simple mechanistic model. If such a system is of limited analytical tractability, brute force simulation is often the only…

机器学习 · 计算机科学 2023-01-04 Hunter Elliott

Network models are widely used as structural summaries of biochemical systems. Statistical estimation of networks is usually based on linear or discrete models. However, the dynamics of these systems are generally nonlinear, suggesting that…

应用统计 · 统计学 2014-06-03 C. J. Oates , F. Dondelinger , N. Bayani , J. Korola , J. W. Gray , S. Mukherjee

End-to-end learning of dynamical systems with black-box models, such as neural ordinary differential equations (ODEs), provides a flexible framework for learning dynamics from data without prescribing a mathematical model for the dynamics.…

机器学习 · 统计学 2022-06-20 Paidamoyo Chapfuwa , Sherri Rose , Lawrence Carin , Edward Meeds , Ricardo Henao

Taking uncertainty into account is crucial when making strategic decisions. To guard against the risk of adverse scenarios, traditional optimisation techniques incorporate uncertainty on the basis of prior knowledge on its distribution. In…

最优化与控制 · 数学 2022-12-06 Julien Vaes , Vassilis M. Charitopoulos
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