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nmrML: A Community Supported Open Data Standard for the Description, Storage, and Exchange of NMR Data.
Schober D, Jacob D, Wilson M, Cruz JA, Marcu A, Grant JR, Moing A, Deborde C, de Figueiredo LF, Haug K, Rocca-Serra P, Easton J, Ebbels TMD, Hao J, Ludwig C, Günther UL, Rosato A, Klein MS, Lewis IA, Luchinat C, Jones AR, Grauslys A, Larralde M, Yokochi M, Kobayashi N, Porzel A, Griffin JL, Viant MR, Wishart DS, Steinbeck C, Salek RM, Neumann S. Schober D, et al. Anal Chem. 2018 Jan 2;90(1):649-656. doi: 10.1021/acs.analchem.7b02795. Epub 2017 Dec 14. Anal Chem. 2018. PMID: 29035042 Free article.
Piecewise multivariate modelling of sequential metabolic profiling data.
Rantalainen M, Cloarec O, Ebbels TM, Lundstedt T, Nicholson JK, Holmes E, Trygg J. Rantalainen M, et al. Among authors: ebbels tm. BMC Bioinformatics. 2008 Feb 19;9:105. doi: 10.1186/1471-2105-9-105. BMC Bioinformatics. 2008. PMID: 18284665 Free PMC article.
MetAssimulo: simulation of realistic NMR metabolic profiles.
Muncey HJ, Jones R, De Iorio M, Ebbels TM. Muncey HJ, et al. Among authors: ebbels tm. BMC Bioinformatics. 2010 Oct 6;11:496. doi: 10.1186/1471-2105-11-496. BMC Bioinformatics. 2010. PMID: 20925910 Free PMC article.
Computational tools and workflows in metabolomics: An international survey highlights the opportunity for harmonisation through Galaxy.
Weber RJM, Lawson TN, Salek RM, Ebbels TMD, Glen RC, Goodacre R, Griffin JL, Haug K, Koulman A, Moreno P, Ralser M, Steinbeck C, Dunn WB, Viant MR. Weber RJM, et al. Metabolomics. 2017;13(2):12. doi: 10.1007/s11306-016-1147-x. Epub 2016 Dec 27. Metabolomics. 2017. PMID: 28090198 Free PMC article. No abstract available.
102 results