Automatic model generation

2019/04/02 by Tibor Nagy, Nagy, Tibor, János Tóth +3
Computer Science · Decision Sciences · Engineering · #FOS: Mathematics #Modeling and Simulation Systems #Numerical Analysis (math.NA) #Real-time simulation and control systems #Simulation Techniques and Applications

paper · pdf · doi:10.48550/arxiv.1904.01272

openalex publication_date 2019/04/02 · openalex created_date 2025/10/10 · openalex updated_date 2026/07/28

Abstract

The goal of the paper is to automatize the selection of mechanisms which are able to describe a set of measurements. In order to do so first we construct a set of possible mechanism fulfilling chemically reasonable requirements with a given number of species and reaction steps. Then we try to fit all the mechanisms, and offer the best fitting one to the chemist for further analysis. The method can also be used to a kind of lumping: to reproduce the results of a big mechanism using a smaller one, with less number of species. We show two applications: one on an artificial example and another one on a small real life data.

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