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A Machine-Learned "Chemical Intuition" to Overcome Spectroscopic Data Scarcity

Cailum M. K. Stienstra, Teun van Wieringen, Liam Hebert, Patrick Thomas, Kas J. Houthuijs, Giel Berden, Jos Oomens, Jonathan Martens, W. Scott Hopkins

Version 1 posted 10 December 2024

141

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Analytical Chemistry

Review

Exploring Single-probe Single-Cell Mass Spectrometry: Current Trends and Future Directions

Deepti Bhusal, Shakya Munige, Zongkai Peng, Zhibo Yang

Version 1 posted 20 December 2024

24

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Analytical Chemistry

Working Paper

Achieving Single-cell Resolution via Desorption Electrospray Ionization Mass Spectrometry Imaging (DESI-MSI)

Nathan Colwell, Dan Chen, Zhibo Yang

Version 1 posted 29 November 2024

345

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Analytical Chemistry

Working Paper

Improved Annotation of Untargeted Metabolomics Data Through Buffer Modifications That Shift Adduct Mass and Intensity

Wenyun Lu, Xi Xing, Lin Wang, Li Chen, Sisi Zhang, Melanie McReynolds, Joshua D Rabinowitz

Version 2 posted 22 June 2020

973

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Analytical Chemistry

Working Paper

Sebum: a window into dysregulation of lipid metabolism in Parkinson’s disease

Eleanor Sinclair, Drupad Trivedi, Depanjan Sarkar, Caitlin Walton-Doyle, Joy Milne, Tilo Kunath, Anouk Rijs, Rob Debie, Royston Goodacre, Monty Silverdale, Perdita Barran

Version 2 posted 30 June 2020

2,197

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1

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Analytical Chemistry

Working Paper

Spatial Metabolomics of the Human Kidney Using MALDI Trapped Ion Mobility Imaging Mass Spectrometry

Elizabeth Neumann, Lukasz Migas, Jamie L. Allen, Richard Caprioli, Raf Van de Plas, Jeffrey Spraggins

Version 2 posted 13 May 2020

1,005

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1

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Analytical Chemistry

Working Paper

In-Plate Metabolomics of Single Zebrafish Embryos

Anton Ribbenstedt, Malte Posselt, Carl Brunius, Jonathan P. Benskin

Version 1 posted 29 October 2019

851

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Analytical Chemistry

Working Paper

Detection of Metabolite-Protein Interactions in Complex Biological Samples by High-Resolution Relaxometry: Towards Interactomics by NMR

Ziqing Wang, Veronica Ghini, Pavel Kaderavek, Simone Pisano, Milan Zachrdla, Philippe Pelupessy, Morgan Kazmierczak, Thorsten Marquardsen, Jean-Max Tyburn, Guillaume Bouvignies, Giacomo Parigi, Claudio Luchinat, Fabien Ferrage

Version 2 posted 01 February 2021

772

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Analytical Chemistry

Working Paper

A Mature ROMANCE: A Matter of Quantity and How Two Can Be Better than One

Santiago Codesido, Nicolas Drouin, Sabrina Ferre, Julie Schappler, Serge Rudaz, Víctor González-Ruiz

Version 1 posted 14 May 2020

532

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1

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Analytical Chemistry

Working Paper

A headspace collection chamber for whole body volatilomics

Stephanie Rankin-Turner, Conor McMeniman

Version 2 posted 25 July 2022

493

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Refine Search

72 results in metabolomics in Keywords: metabolomics

A Machine-Learned "Chemical Intuition" to Overcome Spectroscopic Data Scarcity

Exploring Single-probe Single-Cell Mass Spectrometry: Current Trends and Future Directions

Achieving Single-cell Resolution via Desorption Electrospray Ionization Mass Spectrometry Imaging (DESI-MSI)

Improved Annotation of Untargeted Metabolomics Data Through Buffer Modifications That Shift Adduct Mass and Intensity

Sebum: a window into dysregulation of lipid metabolism in Parkinson’s disease

Spatial Metabolomics of the Human Kidney Using MALDI Trapped Ion Mobility Imaging Mass Spectrometry

In-Plate Metabolomics of Single Zebrafish Embryos

Detection of Metabolite-Protein Interactions in Complex Biological Samples by High-Resolution Relaxometry: Towards Interactomics by NMR

A Mature ROMANCE: A Matter of Quantity and How Two Can Be Better than One

A headspace collection chamber for whole body volatilomics

72 results in Keywords: metabolomics