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LipidFinder on LIPID MAPS: peak filtering, MS searching and statistical analysis for lipidomics

SUMMARY: We present LipidFinder online, hosted on the LIPID MAPS website, as a liquid chromatography/mass spectrometry (LC/MS) workflow comprising peak filtering, MS searching and statistical analysis components, highly customized for interrogating lipidomic data. The online interface of LipidFinder...

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Autores principales: Fahy, Eoin, Alvarez-Jarreta, Jorge, Brasher, Christopher J, Nguyen, An, Hawksworth, Jade I, Rodrigues, Patricia, Meckelmann, Sven, Allen, Stuart M, O'Donnell, Valerie B
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Oxford University Press 2019
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6378932/
https://www.ncbi.nlm.nih.gov/pubmed/30101336
http://dx.doi.org/10.1093/bioinformatics/bty679
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author Fahy, Eoin
Alvarez-Jarreta, Jorge
Brasher, Christopher J
Nguyen, An
Hawksworth, Jade I
Rodrigues, Patricia
Meckelmann, Sven
Allen, Stuart M
O'Donnell, Valerie B
author_facet Fahy, Eoin
Alvarez-Jarreta, Jorge
Brasher, Christopher J
Nguyen, An
Hawksworth, Jade I
Rodrigues, Patricia
Meckelmann, Sven
Allen, Stuart M
O'Donnell, Valerie B
author_sort Fahy, Eoin
collection PubMed
description SUMMARY: We present LipidFinder online, hosted on the LIPID MAPS website, as a liquid chromatography/mass spectrometry (LC/MS) workflow comprising peak filtering, MS searching and statistical analysis components, highly customized for interrogating lipidomic data. The online interface of LipidFinder includes several innovations such as comprehensive parameter tuning, a MS search engine employing in-house customized, curated and computationally generated databases and multiple reporting/display options. A set of integrated statistical analysis tools which enable users to identify those features which are significantly-altered under the selected experimental conditions, thereby greatly reducing the complexity of the peaklist prior to MS searching is included. LipidFinder is presented as a highly flexible, extensible user-friendly online workflow which leverages the lipidomics knowledge base and resources of the LIPID MAPS website, long recognized as a leading global lipidomics portal. AVAILABILITY AND IMPLEMENTATION: LipidFinder on LIPID MAPS is available at: http://www.lipidmaps.org/data/LF.
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spelling pubmed-63789322019-02-22 LipidFinder on LIPID MAPS: peak filtering, MS searching and statistical analysis for lipidomics Fahy, Eoin Alvarez-Jarreta, Jorge Brasher, Christopher J Nguyen, An Hawksworth, Jade I Rodrigues, Patricia Meckelmann, Sven Allen, Stuart M O'Donnell, Valerie B Bioinformatics Applications Notes SUMMARY: We present LipidFinder online, hosted on the LIPID MAPS website, as a liquid chromatography/mass spectrometry (LC/MS) workflow comprising peak filtering, MS searching and statistical analysis components, highly customized for interrogating lipidomic data. The online interface of LipidFinder includes several innovations such as comprehensive parameter tuning, a MS search engine employing in-house customized, curated and computationally generated databases and multiple reporting/display options. A set of integrated statistical analysis tools which enable users to identify those features which are significantly-altered under the selected experimental conditions, thereby greatly reducing the complexity of the peaklist prior to MS searching is included. LipidFinder is presented as a highly flexible, extensible user-friendly online workflow which leverages the lipidomics knowledge base and resources of the LIPID MAPS website, long recognized as a leading global lipidomics portal. AVAILABILITY AND IMPLEMENTATION: LipidFinder on LIPID MAPS is available at: http://www.lipidmaps.org/data/LF. Oxford University Press 2019-02-15 2018-08-07 /pmc/articles/PMC6378932/ /pubmed/30101336 http://dx.doi.org/10.1093/bioinformatics/bty679 Text en © The Author(s) 2018. Published by Oxford University Press. http://creativecommons.org/licenses/by/4.0/ This is an Open Access article distributed under the terms of the Creative Commons Attribution License (http://creativecommons.org/licenses/by/4.0/), which permits unrestricted reuse, distribution, and reproduction in any medium, provided the original work is properly cited.
spellingShingle Applications Notes
Fahy, Eoin
Alvarez-Jarreta, Jorge
Brasher, Christopher J
Nguyen, An
Hawksworth, Jade I
Rodrigues, Patricia
Meckelmann, Sven
Allen, Stuart M
O'Donnell, Valerie B
LipidFinder on LIPID MAPS: peak filtering, MS searching and statistical analysis for lipidomics
title LipidFinder on LIPID MAPS: peak filtering, MS searching and statistical analysis for lipidomics
title_full LipidFinder on LIPID MAPS: peak filtering, MS searching and statistical analysis for lipidomics
title_fullStr LipidFinder on LIPID MAPS: peak filtering, MS searching and statistical analysis for lipidomics
title_full_unstemmed LipidFinder on LIPID MAPS: peak filtering, MS searching and statistical analysis for lipidomics
title_short LipidFinder on LIPID MAPS: peak filtering, MS searching and statistical analysis for lipidomics
title_sort lipidfinder on lipid maps: peak filtering, ms searching and statistical analysis for lipidomics
topic Applications Notes
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6378932/
https://www.ncbi.nlm.nih.gov/pubmed/30101336
http://dx.doi.org/10.1093/bioinformatics/bty679
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