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  5. LipidFinder 2.0: advanced informatics pipeline for lipidomics discovery applications
 
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LipidFinder 2.0: advanced informatics pipeline for lipidomics discovery applications
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LipidFinder 2.0 advanced informatics pipeline for lipidomics discovery applications.pdf (92.83 KB)
Published version
Author(s)
Alvarez-Jarreta, Jorge
Rodrigues, Patricia RS
Fahy, Eoin
O'Connor, Anne
Price, Anna
more
Type
Journal Article
Abstract
We present LipidFinder 2.0, incorporating four new modules that apply artefact filters, remove lipid and contaminant stacks, in-source fragments and salt clusters, and a new isotope deletion method which is significantly more sensitive than available open-access alternatives. We also incorporate a novel false discovery rate method, utilizing a target–decoy strategy, which allows users to assess data quality. A renewed lipid profiling method is introduced which searches three different databases from LIPID MAPS and returns bulk lipid structures only, and a lipid category scatter plot with color blind friendly pallet. An API interface with XCMS Online is made available on LipidFinder’s online version. We show using real data that LipidFinder 2.0 provides a significant improvement over non-lipid metabolite filtering and lipid profiling, compared to available tools.
Date Issued
2021-05-15
Date Acceptance
2020-09-22
Citation
Bioinformatics, 2021, 37 (10), pp.1478-1479
URI
http://hdl.handle.net/10044/1/103916
URL
https://academic.oup.com/bioinformatics/article/37/10/1478/5919072
DOI
https://www.dx.doi.org/10.1093/bioinformatics/btaa856
ISSN
1367-4803
Publisher
Oxford University Press
Start Page
1478
End Page
1479
Journal / Book Title
Bioinformatics
Volume
37
Issue
10
Copyright Statement
© The Author(s) 2020. Published by Oxford University Press.
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.
License URL
https://creativecommons.org/licenses/by/4.0/
Identifier
https://www.webofscience.com/api/gateway?GWVersion=2&SrcApp=PARTNER_APP&SrcAuth=LinksAMR&KeyUT=WOS:000693168900022&DestLinkType=FullRecord&DestApp=ALL_WOS&UsrCustomerID=a2bf6146997ec60c407a63945d4e92bb
Subjects
Biochemical Research Methods
Biochemistry & Molecular Biology
Biotechnology & Applied Microbiology
Computer Science
Computer Science, Interdisciplinary Applications
Life Sciences & Biomedicine
Mathematical & Computational Biology
Mathematics
Physical Sciences
Science & Technology
Statistics & Probability
Technology
Publication Status
Published
Date Publish Online
2020-12-10
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