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Page 1
Reproducible MS/MS library cleaning pipeline in matchms.
de Jonge NF, Hecht H, Strobel M, Wang M, van der Hooft JJJ, Huber F. de Jonge NF, et al. J Cheminform. 2024 Jul 29;16(1):88. doi: 10.1186/s13321-024-00878-1. J Cheminform. 2024. PMID: 39075613 Free PMC article.
Effective data visualization strategies in untargeted metabolomics.
Mildau K, Ehlers H, Meisenburg M, Del Pup E, Koetsier RA, Torres Ortega LR, de Jonge NF, Singh KS, Ferreira D, Othibeng K, Tugizimana F, Huber F, van der Hooft JJJ. Mildau K, et al. Among authors: de jonge nf. Nat Prod Rep. 2024 Dec 2. doi: 10.1039/d4np00039k. Online ahead of print. Nat Prod Rep. 2024. PMID: 39620439 Free PMC article. Review.
MassSpecGym: A benchmark for the discovery and identification of molecules.
Bushuiev R, Bushuiev A, de Jonge NF, Young A, Kretschmer F, Samusevich R, Heirman J, Wang F, Zhang L, Dührkop K, Ludwig M, Haupt NA, Kalia A, Brungs C, Schmid R, Greiner R, Wang B, Wishart DS, Liu LP, Rousu J, Bittremieux W, Rost H, Mak TD, Hassoun S, Huber F, van der Hooft JJJ, Stravs MA, Böcker S, Sivic J, Pluskal T. Bushuiev R, et al. Among authors: de jonge nf. ArXiv [Preprint]. 2025 Jan 14:arXiv:2410.23326v2. ArXiv. 2025. PMID: 39575121 Free PMC article. Preprint.