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XCMS-MRM and METLIN-MRM: a cloud library and public resource for targeted analysis of small molecules.
Domingo-Almenara X, Montenegro-Burke JR, Ivanisevic J, Thomas A, Sidibé J, Teav T, Guijas C, Aisporna AE, Rinehart D, Hoang L, Nordström A, Gómez-Romero M, Whiley L, Lewis MR, Nicholson JK, Benton HP, Siuzdak G. Domingo-Almenara X, et al. Nat Methods. 2018 Sep;15(9):681-684. doi: 10.1038/s41592-018-0110-3. Epub 2018 Aug 27. Nat Methods. 2018. PMID: 30150755 Free PMC article.
Smartphone Analytics: Mobilizing the Lab into the Cloud for Omic-Scale Analyses.
Montenegro-Burke JR, Phommavongsay T, Aisporna AE, Huan T, Rinehart D, Forsberg E, Poole FL, Thorgersen MP, Adams MW, Krantz G, Fields MW, Northen TR, Robbins PD, Niedernhofer LJ, Lairson L, Benton HP, Siuzdak G. Montenegro-Burke JR, et al. Anal Chem. 2016 Oct 4;88(19):9753-9758. doi: 10.1021/acs.analchem.6b02676. Epub 2016 Sep 15. Anal Chem. 2016. PMID: 27560777 Free PMC article.
Exposome-Scale Investigations Guided by Global Metabolomics, Pathway Analysis, and Cognitive Computing.
Warth B, Spangler S, Fang M, Johnson CH, Forsberg EM, Granados A, Martin RL, Domingo-Almenara X, Huan T, Rinehart D, Montenegro-Burke JR, Hilmers B, Aisporna A, Hoang LT, Uritboonthai W, Benton HP, Richardson SD, Williams AJ, Siuzdak G. Warth B, et al. Anal Chem. 2017 Nov 7;89(21):11505-11513. doi: 10.1021/acs.analchem.7b02759. Epub 2017 Oct 9. Anal Chem. 2017. PMID: 28945073
METLIN: A Technology Platform for Identifying Knowns and Unknowns.
Guijas C, Montenegro-Burke JR, Domingo-Almenara X, Palermo A, Warth B, Hermann G, Koellensperger G, Huan T, Uritboonthai W, Aisporna AE, Wolan DW, Spilker ME, Benton HP, Siuzdak G. Guijas C, et al. Anal Chem. 2018 Mar 6;90(5):3156-3164. doi: 10.1021/acs.analchem.7b04424. Epub 2018 Feb 9. Anal Chem. 2018. PMID: 29381867 Free PMC article.
29 results