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Avant-garde: An automated data-driven DIA data curation tool.

Multiple challenges remain in Data-Independent Acquisition (DIA) data analysis, like confidently identifying peptides, defining integration boundaries, removing interferences, and controlling false discovery rates. In practice, a visual inspection of the signals is still required, which is impractic...

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Autores principales: Jacome, Alvaro Sebastian Vaca, Peckner, Ryan, Shulman, Nicholas, Krug, Karsten, DeRuff, Katherine C., Officer, Adam, Christianson, Karen E., MacLean, Brendan, MacCoss, Michael J., Carr, Steven A., Jaffe, Jacob D.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: 2020
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7723322/
https://www.ncbi.nlm.nih.gov/pubmed/33199889
http://dx.doi.org/10.1038/s41592-020-00986-4
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author Jacome, Alvaro Sebastian Vaca
Peckner, Ryan
Shulman, Nicholas
Krug, Karsten
DeRuff, Katherine C.
Officer, Adam
Christianson, Karen E.
MacLean, Brendan
MacCoss, Michael J.
Carr, Steven A.
Jaffe, Jacob D.
author_facet Jacome, Alvaro Sebastian Vaca
Peckner, Ryan
Shulman, Nicholas
Krug, Karsten
DeRuff, Katherine C.
Officer, Adam
Christianson, Karen E.
MacLean, Brendan
MacCoss, Michael J.
Carr, Steven A.
Jaffe, Jacob D.
author_sort Jacome, Alvaro Sebastian Vaca
collection PubMed
description Multiple challenges remain in Data-Independent Acquisition (DIA) data analysis, like confidently identifying peptides, defining integration boundaries, removing interferences, and controlling false discovery rates. In practice, a visual inspection of the signals is still required, which is impractical with large datasets. We developed Avant-garde as a tool to refine DIA (and PRM) data. Avant-garde uses a novel data-driven scoring strategy; signals are refined by learning from the data itself, using all measurements in all samples to achieve the best optimization. We evaluated Avant-garde’s performance with benchmarking DIA datasets. We showed that it can determine the quantitative suitability of a peptide peak, and reaches the same levels of selectivity, accuracy, and reproducibility as manual validation. Avant-garde is complementary to existing DIA analysis engines and aims to establish a strong foundation for subsequent analysis of quantitative MS data.
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spelling pubmed-77233222021-05-16 Avant-garde: An automated data-driven DIA data curation tool. Jacome, Alvaro Sebastian Vaca Peckner, Ryan Shulman, Nicholas Krug, Karsten DeRuff, Katherine C. Officer, Adam Christianson, Karen E. MacLean, Brendan MacCoss, Michael J. Carr, Steven A. Jaffe, Jacob D. Nat Methods Article Multiple challenges remain in Data-Independent Acquisition (DIA) data analysis, like confidently identifying peptides, defining integration boundaries, removing interferences, and controlling false discovery rates. In practice, a visual inspection of the signals is still required, which is impractical with large datasets. We developed Avant-garde as a tool to refine DIA (and PRM) data. Avant-garde uses a novel data-driven scoring strategy; signals are refined by learning from the data itself, using all measurements in all samples to achieve the best optimization. We evaluated Avant-garde’s performance with benchmarking DIA datasets. We showed that it can determine the quantitative suitability of a peptide peak, and reaches the same levels of selectivity, accuracy, and reproducibility as manual validation. Avant-garde is complementary to existing DIA analysis engines and aims to establish a strong foundation for subsequent analysis of quantitative MS data. 2020-11-16 2020-12 /pmc/articles/PMC7723322/ /pubmed/33199889 http://dx.doi.org/10.1038/s41592-020-00986-4 Text en Users may view, print, copy, and download text and data-mine the content in such documents, for the purposes of academic research, subject always to the full Conditions of use:http://www.nature.com/authors/editorial_policies/license.html#terms
spellingShingle Article
Jacome, Alvaro Sebastian Vaca
Peckner, Ryan
Shulman, Nicholas
Krug, Karsten
DeRuff, Katherine C.
Officer, Adam
Christianson, Karen E.
MacLean, Brendan
MacCoss, Michael J.
Carr, Steven A.
Jaffe, Jacob D.
Avant-garde: An automated data-driven DIA data curation tool.
title Avant-garde: An automated data-driven DIA data curation tool.
title_full Avant-garde: An automated data-driven DIA data curation tool.
title_fullStr Avant-garde: An automated data-driven DIA data curation tool.
title_full_unstemmed Avant-garde: An automated data-driven DIA data curation tool.
title_short Avant-garde: An automated data-driven DIA data curation tool.
title_sort avant-garde: an automated data-driven dia data curation tool.
topic Article
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7723322/
https://www.ncbi.nlm.nih.gov/pubmed/33199889
http://dx.doi.org/10.1038/s41592-020-00986-4
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