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point in time: 31 December 2023
Timestamp+2023-12-31T00:00:00Z
Timezone+00:00
CalendarGregorian
Precision1 day
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Latest revision as of 18:14, 21 March 2024

Automated Spectral Deconvolution, Alignment, and Metabolite Identification in GC/MS-Based Untargeted Metabolomics
Language Label Description Also known as
English
erah
Automated Spectral Deconvolution, Alignment, and Metabolite Identification in GC/MS-Based Untargeted Metabolomics

    Statements

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    1.1.2
    11 May 2021
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    1.0.0
    15 April 2016
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    1.0.1
    22 April 2016
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    1.0.2
    2 September 2016
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    1.0.3
    14 October 2016
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    1.0.4
    18 October 2016
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    1.0.5
    14 January 2017
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    1.1.0
    11 July 2018
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    1.1.1
    6 July 2020
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    2.0.0
    2 December 2023
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    2.0.1
    20 December 2023
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    20 December 2023
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    Automated compound deconvolution, alignment across samples, and identification of metabolites by spectral library matching in Gas Chromatography - Mass spectrometry (GC-MS) untargeted metabolomics. Outputs a table with compound names, matching scores and the integrated area of the compound for each sample. Package implementation is described in Domingo-Almenara et al. (2016) <doi:10.1021/acs.analchem.6b02927>.
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