Application of a molecular networking approach using LC-HRMS combined with the MetWork webserver for clinical and forensic toxicology
The workflow increases confidence in toxicological screening by highlighting putative structures in biological matrices in combination with CFM-ID (Competitive Fragmentation Modeling for Metabolite Identification) and MetWork to extend the annotation of potential drugs even without a reference standard.
Authors
- Yann Beauxis
- Romain Magny (ORCID: https://orcid.org/0000-0003-3766-8509)
- Grégory Genta‐Jouve (ORCID: https://orcid.org/0000-0002-9239-4371)
- E. Bourgogne (ORCID: https://orcid.org/0000-0001-7753-8587)
Institutions
- Centre National de la Recherche Scientifique (FR)
- Université Paris Cité (FR)
- Sorbonne Paris Cité (FR)
- Assistance Publique – Hôpitaux de Paris (FR)
- Hôpital Lariboisière (FR)
- Hôpital Bichat-Claude-Bernard (FR)
Publication Details
- Journal
- Heliyon
- Published
- 2024-08-30
- DOI
- https://doi.org/10.1016/j.heliyon.2024.e36735
- Citations
- 5
- Primary Topic
- Metabolomics and Mass Spectrometry Studies
- Type
- article
- Field-Weighted Citation Impact
- 1.17