Skip to main page content
U.S. flag

An official website of the United States government

Dot gov

The .gov means it’s official.
Federal government websites often end in .gov or .mil. Before sharing sensitive information, make sure you’re on a federal government site.

Https

The site is secure.
The https:// ensures that you are connecting to the official website and that any information you provide is encrypted and transmitted securely.

Access keys NCBI Homepage MyNCBI Homepage Main Content Main Navigation

Search Page

Filters

My Custom Filters

Publication date

Text availability

Article attribute

Article type

Additional filters

Article Language

Species

Sex

Age

Other

Search Results

103 results

Filters applied: . Clear all
Results are displayed in a computed author sort order. The Publication Date timeline is not available.
Page 1
Introducing "Identification Probability" for Automated and Transferable Assessment of Metabolite Identification Confidence in Metabolomics and Related Studies.
Metz TO, Chang CH, Gautam V, Anjum A, Tian S, Wang F, Colby SM, Nunez JR, Blumer MR, Edison AS, Fiehn O, Jones DP, Li S, Morgan ET, Patti GJ, Ross DH, Shapiro MR, Williams AJ, Wishart DS. Metz TO, et al. Among authors: nunez jr. Anal Chem. 2024 Dec 19. doi: 10.1021/acs.analchem.4c04060. Online ahead of print. Anal Chem. 2024. PMID: 39699939 Review.
DEIMoS: An Open-Source Tool for Processing High-Dimensional Mass Spectrometry Data.
Colby SM, Chang CH, Bade JL, Nunez JR, Blumer MR, Orton DJ, Bloodsworth KJ, Nakayasu ES, Smith RD, Ibrahim YM, Renslow RS, Metz TO. Colby SM, et al. Among authors: nunez jr. Anal Chem. 2022 Apr 26;94(16):6130-6138. doi: 10.1021/acs.analchem.1c05017. Epub 2022 Apr 17. Anal Chem. 2022. PMID: 35430813 Free PMC article.
Introducing 'identification probability' for automated and transferable assessment of metabolite identification confidence in metabolomics and related studies.
Metz TO, Chang CH, Gautam V, Anjum A, Tian S, Wang F, Colby SM, Nunez JR, Blumer MR, Edison AS, Fiehn O, Jones DP, Li S, Morgan ET, Patti GJ, Ross DH, Shapiro MR, Williams AJ, Wishart DS. Metz TO, et al. Among authors: nunez jr. bioRxiv [Preprint]. 2024 Jul 31:2024.07.30.605945. doi: 10.1101/2024.07.30.605945. bioRxiv. 2024. Update in: Anal Chem. 2024 Dec 19. doi: 10.1021/acs.analchem.4c04060 PMID: 39131324 Free PMC article. Updated. Preprint.
Quantum Chemistry Calculations for Metabolomics.
Borges RM, Colby SM, Das S, Edison AS, Fiehn O, Kind T, Lee J, Merrill AT, Merz KM Jr, Metz TO, Nunez JR, Tantillo DJ, Wang LP, Wang S, Renslow RS. Borges RM, et al. Among authors: nunez jr. Chem Rev. 2021 May 26;121(10):5633-5670. doi: 10.1021/acs.chemrev.0c00901. Epub 2021 May 12. Chem Rev. 2021. PMID: 33979149 Free PMC article. Review.
Mass Spectrometry Adduct Calculator.
Blumer MR, Chang CH, Brayfindley E, Nunez JR, Colby SM, Renslow RS, Metz TO. Blumer MR, et al. Among authors: nunez jr. J Chem Inf Model. 2021 Dec 27;61(12):5721-5725. doi: 10.1021/acs.jcim.1c00579. Epub 2021 Nov 29. J Chem Inf Model. 2021. PMID: 34842435 Free PMC article.
103 results