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Conference papers

A Rule-Based Approach for Automated Generation of Kinetic Chemical Mechanisms

Olivier Bournez 1 Guy-Marie Côme 2 Valérie Conraud 2 Hélène Kirchner 1 Liliana Ibanescu 1
1 PROTHEO - Constraints, automatic deduction and software properties proofs
INRIA Lorraine, LORIA - Laboratoire Lorrain de Recherche en Informatique et ses Applications
2 DCPR - Département de Chimie Physique des Réactions
Abstract : Several software systems have been developed recently for the automated generation of combustion reactions kinetic mechanisms using different representations of species and reactions and different generation algorithms. In parallel, several software systems based on rewriting have been developed for the easy modeling and prototyping of systems using rules controlled by strategies. This paper presents our current experience in using the rewrite system \ELAN\ for the automated generation of the combustion reactions mechanisms previously implemented in the \EXGAS\ kinetic mechanism generator system. We emphasize the benefits of using rewriting and rule-based programming controlled by strategies for the generation of kinetic mechanisms.
Keywords : réécriture chemistry rewriting rule based programing programmation par règles chimie
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Conference papers
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https://hal.inria.fr/inria-00099621
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Submitted on : Tuesday, September 26, 2006 - 9:39:29 AM
Last modification on : Friday, May 13, 2022 - 10:18:05 PM

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  • HAL Id : inria-00099621, version 1

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INRIA | CNRS | LORIA | UNIV-LORRAINE | INRIA2

Citation

Olivier Bournez, Guy-Marie Côme, Valérie Conraud, Hélène Kirchner, Liliana Ibanescu. A Rule-Based Approach for Automated Generation of Kinetic Chemical Mechanisms. 14th International Conference on Rewriting Techniques and Applications - RTA'2003, Jun 2003, Valencia, Spain, pp.30-45. ⟨inria-00099621⟩

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