eprintid: 20076 rev_number: 16 eprint_status: archive userid: 1589 dir: disk0/00/02/00/76 datestamp: 2016-02-17 09:47:22 lastmod: 2024-03-09 10:17:47 status_changed: 2016-02-17 09:47:22 type: article metadata_visibility: show creators_name: Surovtsova, Irina creators_name: Simus, Natalia creators_name: Hübner, Katrin creators_name: Sahle, Sven creators_name: Kummer, Ursula title: Simplification of biochemical models: a general approach based on the analysis of the impact of individual species and reactions on the systems dynamics subjects: 570 divisions: 140001 divisions: 708000 divisions: 716000 divisions: 718000 divisions: 721000 divisions: 852300 abstract: Background: Given the complex mechanisms underlying biochemical processes systems biology researchers tend to build ever increasing computational models. However, dealing with complex systems entails a variety of problems, e.g. difficult intuitive understanding, variety of time scales or non-identifiable parameters. Therefore, methods are needed that, at least semi-automatically, help to elucidate how the complexity of a model can be reduced such that important behavior is maintained and the predictive capacity of the model is increased. The results should be easily accessible and interpretable. In the best case such methods may also provide insight into fundamental biochemical mechanisms. Results: We have developed a strategy based on the Computational Singular Perturbation (CSP) method which can be used to perform a "biochemically-driven" model reduction of even large and complex kinetic ODE systems. We provide an implementation of the original CSP algorithm in COPASI (a COmplex PAthway SImulator) and applied the strategy to two example models of different degree of complexity - a simple one-enzyme system and a full-scale model of yeast glycolysis. Conclusion: The results show the usefulness of the method for model simplification purposes as well as for analyzing fundamental biochemical mechanisms. COPASI is freely available at http://www.copasi.org. date: 2012 publisher: BioMed Central id_scheme: DOI ppn_swb: 1656588846 own_urn: urn:nbn:de:bsz:16-heidok-200760 language: eng bibsort: SUROVTSOVASIMPLIFICA2012 full_text_status: public publication: BMC Systems Biology volume: 6 number: 14 place_of_pub: London pagerange: 1-16 issn: 1752-0509 citation: Surovtsova, Irina ; Simus, Natalia ; Hübner, Katrin ; Sahle, Sven ; Kummer, Ursula (2012) Simplification of biochemical models: a general approach based on the analysis of the impact of individual species and reactions on the systems dynamics. BMC Systems Biology, 6 (14). pp. 1-16. ISSN 1752-0509 document_url: https://archiv.ub.uni-heidelberg.de/volltextserver/20076/1/12918_2011_Article_857.pdf