CASMDB: An Open-Source Database of Metabolite Annotation Data for 1D 1H NMR-Based Metabolomics.

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Title: CASMDB: An Open-Source Database of Metabolite Annotation Data for 1D 1H NMR-Based Metabolomics.
Authors: Hayward MW; Division of Molecular and Cell Biology, Leicester Institute of Structural and Chemical Biology, University of Leicester, Henry Wellcome Building, Lancaster Road, Leicester LE1 7HN, United Kingdom., Mureddu LG; Division of Molecular and Cell Biology, Leicester Institute of Structural and Chemical Biology, University of Leicester, Henry Wellcome Building, Lancaster Road, Leicester LE1 7HN, United Kingdom., Thompson GS; School of Natural Sciences, University of Kent, Canterbury CT2 7NZ, United Kingdom., Phelan MM; Liverpool Shared Research Facilities (LivSRF) & Institute of Systems, Molecular and Integrative Biology, NMR Centre for Structural Biology, University of Liverpool, Crown Street, Liverpool L69 7ZB, United Kingdom., Brooksbank EJ; Division of Molecular and Cell Biology, Leicester Institute of Structural and Chemical Biology, University of Leicester, Henry Wellcome Building, Lancaster Road, Leicester LE1 7HN, United Kingdom., Vuister GW; Division of Molecular and Cell Biology, Leicester Institute of Structural and Chemical Biology, University of Leicester, Henry Wellcome Building, Lancaster Road, Leicester LE1 7HN, United Kingdom.
Source: Analytical chemistry [Anal Chem] 2026 May 05; Vol. 98 (17), pp. 12224-12233. Date of Electronic Publication: 2026 Apr 21.
Publication Type: Journal Article
Journal Info: Publisher: American Chemical Society Country of Publication: United States NLM ID: 0370536 Publication Model: Print-Electronic Cited Medium: Internet ISSN: 1520-6882 (Electronic) Linking ISSN: 00032700 NLM ISO Abbreviation: Anal Chem Subsets: MEDLINE
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  Data: CASMDB: An Open-Source Database of Metabolite Annotation Data for 1D <superscript>1</superscript>H NMR-Based Metabolomics.
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  Data: <searchLink fieldCode="AU" term="%22Hayward+MW%22">Hayward MW</searchLink>; Division of Molecular and Cell Biology, Leicester Institute of Structural and Chemical Biology, University of Leicester, Henry Wellcome Building, Lancaster Road, Leicester LE1 7HN, United Kingdom.<br /><searchLink fieldCode="AU" term="%22Mureddu+LG%22">Mureddu LG</searchLink>; Division of Molecular and Cell Biology, Leicester Institute of Structural and Chemical Biology, University of Leicester, Henry Wellcome Building, Lancaster Road, Leicester LE1 7HN, United Kingdom.<br /><searchLink fieldCode="AU" term="%22Thompson+GS%22">Thompson GS</searchLink>; School of Natural Sciences, University of Kent, Canterbury CT2 7NZ, United Kingdom.<br /><searchLink fieldCode="AU" term="%22Phelan+MM%22">Phelan MM</searchLink>; Liverpool Shared Research Facilities (LivSRF) & Institute of Systems, Molecular and Integrative Biology, NMR Centre for Structural Biology, University of Liverpool, Crown Street, Liverpool L69 7ZB, United Kingdom.<br /><searchLink fieldCode="AU" term="%22Brooksbank+EJ%22">Brooksbank EJ</searchLink>; Division of Molecular and Cell Biology, Leicester Institute of Structural and Chemical Biology, University of Leicester, Henry Wellcome Building, Lancaster Road, Leicester LE1 7HN, United Kingdom.<br /><searchLink fieldCode="AU" term="%22Vuister+GW%22">Vuister GW</searchLink>; Division of Molecular and Cell Biology, Leicester Institute of Structural and Chemical Biology, University of Leicester, Henry Wellcome Building, Lancaster Road, Leicester LE1 7HN, United Kingdom.
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  Data: <searchLink fieldCode="JN" term="%220370536%22">Analytical chemistry</searchLink> [Anal Chem] 2026 May 05; Vol. 98 (17), pp. 12224-12233. <i>Date of Electronic Publication: </i>2026 Apr 21.
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        Value: 10.1021/acs.analchem.5c04525
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        StartPage: 12224
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      – TitleFull: CASMDB: An Open-Source Database of Metabolite Annotation Data for 1D 1H NMR-Based Metabolomics.
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              Text: 2026 May 05
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