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MetaFetcheR : An R Package for Complete Mapping of Small-Compound Data

Yones, Sara A. (author)
Uppsala universitet,Beräkningsbiologi och bioinformatik,Institutionen för cell- och molekylärbiologi
Csombordi, Rajmund (author)
Uppsala universitet,Institutionen för cell- och molekylärbiologi
Komorowski, Jan (author)
Uppsala universitet,Beräkningsbiologi och bioinformatik,Kollegiet för avancerade studier (SCAS),Institute of Computer Science, Polish Academy of Sciences, Warsaw, Poland.; Washington National Primate Research Center, Seattle, WA, USA.
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Diamanti, Klev, 1987- (author)
Uppsala universitet,Beräkningsbiologi och bioinformatik,Medicinsk genetik och genomik
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 (creator_code:org_t)
2021-10-28
2021
English.
In: Metabolites. - : MDPI. - 2218-1989 .- 2218-1989. ; 11:11
  • Journal article (peer-reviewed)
Abstract Subject headings
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  • Small-compound databases contain a large amount of information for metabolites and metabolic pathways. However, the plethora of such databases and the redundancy of their information lead to major issues with analysis and standardization. A lack of preventive establishment of means of data access at the infant stages of a project might lead to mislabelled compounds, reduced statistical power, and large delays in delivery of results. We developed MetaFetcheR, an open-source R package that links metabolite data from several small-compound databases, resolves inconsistencies, and covers a variety of use-cases of data fetching. We showed that the performance of MetaFetcheR was superior to existing approaches and databases by benchmarking the performance of the algorithm in three independent case studies based on two published datasets.

Subject headings

NATURVETENSKAP  -- Data- och informationsvetenskap -- Datavetenskap (hsv//swe)
NATURAL SCIENCES  -- Computer and Information Sciences -- Computer Sciences (hsv//eng)
NATURVETENSKAP  -- Data- och informationsvetenskap -- Bioinformatik (hsv//swe)
NATURAL SCIENCES  -- Computer and Information Sciences -- Bioinformatics (hsv//eng)

Keyword

small-compound databases
metabolomics
metabolites
queue-based algorithm

Publication and Content Type

ref (subject category)
art (subject category)

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Yones, Sara A.
Csombordi, Rajmu ...
Komorowski, Jan
Diamanti, Klev, ...
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NATURAL SCIENCES
NATURAL SCIENCES
and Computer and Inf ...
and Computer Science ...
NATURAL SCIENCES
NATURAL SCIENCES
and Computer and Inf ...
and Bioinformatics
Articles in the publication
Metabolites
By the university
Uppsala University

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