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ChemEmbed: A deep learning framework for metabolite identification using enhanced MS/MS data and multidimensional molecular embeddings

2025-02-08 | Preprint
Contributors: Muhammad Faizan-Khan; Roger Giné; Josep M. Badia; Maribel Pérez-Ribera; Alexandra Junza; Maria Vinaixa; Marta Sales-Pardo; Roger Guimerà; Oscar Yanes
Source: check_circle
Crossref

Improving MALDI Mass Spectrometry Imaging Performance: Low-Temperature Thermal Evaporation for Controlled Matrix Deposition and Improved Image Quality

2025-01-08 | Preprint
Contributors: Toufik Mahamdi; Cristina Gomez Serna; Roger Giné; Jordi Rofes; Shad Arif Mohammed; Pere Ràfols; Xavier Correig; María García-Altares; Carsten Hopf; Stefania-Alexandra Iakab et al.
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Crossref

HERMES: A molecular formula-oriented method to target the metabolome

bioRxiv
2021 | Other
EID:

2-s2.0-85105334805

Part of ISSN: 26928205
Contributors: Giné, R.; Capellades, J.; Badia, J.M.; Vughs, D.; Schwaiger-Haber, M.; Vinaixa, M.; Brunner, A.M.; Patti, G.J.; Yanes, O.
Source: Self-asserted source
Roger Giné Bertomeu via Scopus - Elsevier

HERMES: a molecular-formula-oriented method to target the metabolome

Nature Methods
2021-11 | Journal article
Part of ISSN: 1548-7091
Part of ISSN: 1548-7105
Source: Self-asserted source
Roger Giné Bertomeu
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Preferred source (of 2)‎

A collection of molecular formula databases for HERMES

2021-06-24 | Dataset
Source: Self-asserted source
Roger Giné Bertomeu

HERMES: a molecular formula-oriented method to target the metabolome - Dataset

2021-06-22 | Dataset
Source: Self-asserted source
Roger Giné Bertomeu