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ChiMera: an easy to use pipeline for bacterial genome based metabolic network reconstruction, evaluation and visualization

BACKGROUND: Genome-scale metabolic reconstruction tools have been developed in the last decades. They have helped to reconstruct eukaryotic and prokaryotic metabolic models, which have contributed to fields, e.g., genetic engineering, drug discovery, prediction of phenotypes, and other model-driven...

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Autores principales: Tamasco, Gustavo, Kumar, Manish, Zengler, Karsten, Silva-Rocha, Rafael, da Silva, Ricardo Roberto
Formato: Online Artículo Texto
Lenguaje:English
Publicado: BioMed Central 2022
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9710178/
https://www.ncbi.nlm.nih.gov/pubmed/36451100
http://dx.doi.org/10.1186/s12859-022-05056-4
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author Tamasco, Gustavo
Kumar, Manish
Zengler, Karsten
Silva-Rocha, Rafael
da Silva, Ricardo Roberto
author_facet Tamasco, Gustavo
Kumar, Manish
Zengler, Karsten
Silva-Rocha, Rafael
da Silva, Ricardo Roberto
author_sort Tamasco, Gustavo
collection PubMed
description BACKGROUND: Genome-scale metabolic reconstruction tools have been developed in the last decades. They have helped to reconstruct eukaryotic and prokaryotic metabolic models, which have contributed to fields, e.g., genetic engineering, drug discovery, prediction of phenotypes, and other model-driven discoveries. However, the use of these programs requires a high level of bioinformatic skills. Moreover, the functionalities required to build models are scattered throughout multiple tools, requiring knowledge and experience for utilizing several tools. RESULTS: Here we present ChiMera, which combines tools used for model reconstruction, prediction, and visualization. ChiMera uses CarveMe in the reconstruction module, generating a gap-filled draft reconstruction able to produce growth predictions using flux balance analysis for gram-positive and gram-negative bacteria. ChiMera also contains two modules for metabolic network visualization. The first module generates maps for the most important pathways, e.g., glycolysis, nucleotides and amino acids biosynthesis, fatty acid oxidation and biosynthesis and core-metabolism. The second module produces a genome-wide metabolic map, which can be used to retrieve KEGG pathway information for each compound in the model. A module to investigate gene essentiality and knockout is also present. CONCLUSIONS: Overall, ChiMera uses automation algorithms to combine a variety of tools to automatically perform model creation, gap-filling, flux balance analysis (FBA), and metabolic network visualization. ChiMera models readily provide metabolic insights that can aid genetic engineering projects, prediction of phenotypes, and model-driven discoveries. SUPPLEMENTARY INFORMATION: The online version contains supplementary material available at 10.1186/s12859-022-05056-4.
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spelling pubmed-97101782022-12-01 ChiMera: an easy to use pipeline for bacterial genome based metabolic network reconstruction, evaluation and visualization Tamasco, Gustavo Kumar, Manish Zengler, Karsten Silva-Rocha, Rafael da Silva, Ricardo Roberto BMC Bioinformatics Software BACKGROUND: Genome-scale metabolic reconstruction tools have been developed in the last decades. They have helped to reconstruct eukaryotic and prokaryotic metabolic models, which have contributed to fields, e.g., genetic engineering, drug discovery, prediction of phenotypes, and other model-driven discoveries. However, the use of these programs requires a high level of bioinformatic skills. Moreover, the functionalities required to build models are scattered throughout multiple tools, requiring knowledge and experience for utilizing several tools. RESULTS: Here we present ChiMera, which combines tools used for model reconstruction, prediction, and visualization. ChiMera uses CarveMe in the reconstruction module, generating a gap-filled draft reconstruction able to produce growth predictions using flux balance analysis for gram-positive and gram-negative bacteria. ChiMera also contains two modules for metabolic network visualization. The first module generates maps for the most important pathways, e.g., glycolysis, nucleotides and amino acids biosynthesis, fatty acid oxidation and biosynthesis and core-metabolism. The second module produces a genome-wide metabolic map, which can be used to retrieve KEGG pathway information for each compound in the model. A module to investigate gene essentiality and knockout is also present. CONCLUSIONS: Overall, ChiMera uses automation algorithms to combine a variety of tools to automatically perform model creation, gap-filling, flux balance analysis (FBA), and metabolic network visualization. ChiMera models readily provide metabolic insights that can aid genetic engineering projects, prediction of phenotypes, and model-driven discoveries. SUPPLEMENTARY INFORMATION: The online version contains supplementary material available at 10.1186/s12859-022-05056-4. BioMed Central 2022-11-30 /pmc/articles/PMC9710178/ /pubmed/36451100 http://dx.doi.org/10.1186/s12859-022-05056-4 Text en © The Author(s) 2022 https://creativecommons.org/licenses/by/4.0/Open AccessThis article is licensed under a Creative Commons Attribution 4.0 International License, which permits use, sharing, adaptation, distribution and reproduction in any medium or format, as long as you give appropriate credit to the original author(s) and the source, provide a link to the Creative Commons licence, and indicate if changes were made. The images or other third party material in this article are included in the article's Creative Commons licence, unless indicated otherwise in a credit line to the material. If material is not included in the article's Creative Commons licence and your intended use is not permitted by statutory regulation or exceeds the permitted use, you will need to obtain permission directly from the copyright holder. To view a copy of this licence, visit http://creativecommons.org/licenses/by/4.0/ (https://creativecommons.org/licenses/by/4.0/) . The Creative Commons Public Domain Dedication waiver (http://creativecommons.org/publicdomain/zero/1.0/ (https://creativecommons.org/publicdomain/zero/1.0/) ) applies to the data made available in this article, unless otherwise stated in a credit line to the data.
spellingShingle Software
Tamasco, Gustavo
Kumar, Manish
Zengler, Karsten
Silva-Rocha, Rafael
da Silva, Ricardo Roberto
ChiMera: an easy to use pipeline for bacterial genome based metabolic network reconstruction, evaluation and visualization
title ChiMera: an easy to use pipeline for bacterial genome based metabolic network reconstruction, evaluation and visualization
title_full ChiMera: an easy to use pipeline for bacterial genome based metabolic network reconstruction, evaluation and visualization
title_fullStr ChiMera: an easy to use pipeline for bacterial genome based metabolic network reconstruction, evaluation and visualization
title_full_unstemmed ChiMera: an easy to use pipeline for bacterial genome based metabolic network reconstruction, evaluation and visualization
title_short ChiMera: an easy to use pipeline for bacterial genome based metabolic network reconstruction, evaluation and visualization
title_sort chimera: an easy to use pipeline for bacterial genome based metabolic network reconstruction, evaluation and visualization
topic Software
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9710178/
https://www.ncbi.nlm.nih.gov/pubmed/36451100
http://dx.doi.org/10.1186/s12859-022-05056-4
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