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Renaud, Nicolas; Jung, Yong; Honavar, Vasant; Geng, Cunliang; Bonvin, Alexandre M.J.J.; Xue, Li C. (, SoftwareX)
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Geng, Cunliang; Jung, Yong; Renaud, Nicolas; Honavar, Vasant; Bonvin, Alexandre M; Xue, Li C; Valencia, Alfonso (, Bioinformatics)
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microbeMASST: a taxonomically informed mass spectrometry search tool for microbial metabolomics dataZuffa, Simone; Schmid, Robin; Bauermeister, Anelize; P. Gomes, Paulo Wender; Caraballo-Rodriguez, Andres M.; El Abiead, Yasin; Aron, Allegra T.; Gentry, Emily C.; Zemlin, Jasmine; Meehan, Michael J.; et al (, Nature Microbiology)Abstract microbeMASST, a taxonomically informed mass spectrometry (MS) search tool, tackles limited microbial metabolite annotation in untargeted metabolomics experiments. Leveraging a curated database of >60,000 microbial monocultures, users can search known and unknown MS/MS spectra and link them to their respective microbial producers via MS/MS fragmentation patterns. Identification of microbe-derived metabolites and relative producers without a priori knowledge will vastly enhance the understanding of microorganisms’ role in ecology and human health.more » « less
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Lensink, Marc F.; Brysbaert, Guillaume; Nadzirin, Nurul; Velankar, Sameer; Chaleil, Raphaël A.; Gerguri, Tereza; Bates, Paul A.; Laine, Elodie; Carbone, Alessandra; Grudinin, Sergei; et al (, Proteins: Structure, Function, and Bioinformatics)
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