Tandem mass spectrum prediction for small molecules using graph transformers-Reference-Cited by-同舟云学术

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Tandem mass spectrum prediction for small molecules using graph transformers

Published:2024-04-05 Issue:4 Volume:6 Page:404-416
ISSN:2522-5839
Container-title:Nature Machine Intelligence
language:en
Short-container-title:Nat Mach Intell

Author:

Young Adamo,Röst Hannes^ORCID,Wang Bo^ORCID

Funder

Canadian Institute for Advanced Research

Gouvernement du Canada | Natural Sciences and Engineering Research Council of Canada

University Health Network

Vector Institute

Gouvernement du Canada | Canadian Institutes of Health Research

Canada Research Chairs

Canadian Foundation for Innovation

Publisher

Springer Science and Business Media LLC

Link

https://www.nature.com/articles/s42256-024-00816-8.pdf

Reference97 articles.

1. Gross, J. H. Mass Spectrometry—A Textbook (Springer, 2011); https://doi.org/10.1007/978-3-319-54398-7

2. Niessen, W. M. A. & Falck, D. in Analyzing Biomolecular Interactions by Mass Spectrometry Ch. 1 (eds Kool, J. & Niessen, W. M. A.) (Wiley, 2015); https://doi.org/10.1002/9783527673391

3. Aebersold, R. & Mann, M. Mass-spectrometric exploration of proteome structure and function. Nature 537, 347–355 (2016).

4. Gowda, G. A. N. & Djukovic, D. Overview of mass spectrometry-based metabolomics: opportunities and challenges. Methods Mol. Biol. 1198, 3–12 (2014).

5. De Vijlder, T. & Cuyckens, F. A tutorial in small molecule identification via electrospray ionization-mass spectrometry: the practical art of structural elucidation. Mass Spectrom. Rev. 37, 607–629 (2018).

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