[HTML][HTML] Recent advances in metabolomics analysis for early drug development

JC Alarcon-Barrera, S Kostidis, A Ondo-Mendez… - Drug discovery today, 2022 - Elsevier
Highlights•Metabolomics has become a widely applied tool in drug development.•
Metabolomics plays a key role for the identification of physiological response markers.• …

Recent advances in mass spectrometry-based computational metabolomics

TMD Ebbels, JJJ van der Hooft, H Chatelaine… - Current opinion in …, 2023 - Elsevier
The computational metabolomics field brings together computer scientists, bioinformaticians,
chemists, clinicians, and biologists to maximize the impact of metabolomics across a wide …

The NORMAN Suspect List Exchange (NORMAN-SLE): facilitating European and worldwide collaboration on suspect screening in high resolution mass spectrometry

H Mohammed Taha, R Aalizadeh, N Alygizakis… - Environmental Sciences …, 2022 - Springer
Abstract Background The NORMAN Association (https://www. norman-network. com/)
initiated the NORMAN Suspect List Exchange (NORMAN-SLE; https://www. norman …

BUDDY: molecular formula discovery via bottom-up MS/MS interrogation

S Xing, S Shen, B Xu, X Li, T Huan - Nature Methods, 2023 - nature.com
A substantial fraction of metabolic features remains undetermined in mass spectrometry
(MS)-based metabolomics, and molecular formula annotation is the starting point for …

The changing metabolic landscape of bile acids–keys to metabolism and immune regulation

I Mohanty, C Allaband, H Mannochio-Russo… - Nature reviews …, 2024 - nature.com
Bile acids regulate nutrient absorption and mitochondrial function, they establish and
maintain gut microbial community composition and mediate inflammation, and they serve as …

LC/MS-based untargeted metabolomics analysis in women with morbid obesity and associated type 2 diabetes mellitus

T Auguet, L Bertran, J Capellades, S Abelló… - International Journal of …, 2023 - mdpi.com
Obesity is a chronic and complex disease, with an increasing incidence worldwide that is
associated with metabolic disorders such as type 2 diabetes mellitus (T2DM). Thus, it is …

Evaluation of data-dependent MS/MS acquisition parameters for non-targeted metabolomics and molecular networking of environmental samples: Focus on the Q …

P Stincone, AK Pakkir Shah, R Schmid… - Analytical …, 2023 - ACS Publications
Non-targeted liquid chromatography–tandem mass spectrometry (LC–MS/MS) is a widely
used tool for metabolomics analysis, enabling the detection and annotation of small …

Metabolic flux between organs measured by arteriovenous metabolite gradients

H Bae, K Lam, C Jang - Experimental & molecular medicine, 2022 - nature.com
Mammalian organs convert dietary nutrients into circulating metabolites and share them to
maintain whole-body metabolic homeostasis. While the concentrations of circulating …

MetaboAnalystR 4.0: a unified LC-MS workflow for global metabolomics

Z Pang, L Xu, C Viau, Y Lu, R Salavati, N Basu… - Nature …, 2024 - nature.com
The wide applications of liquid chromatography-mass spectrometry (LC-MS) in untargeted
metabolomics demand an easy-to-use, comprehensive computational workflow to support …

[HTML][HTML] Acute aerobic exercise reveals that FAHFAs distinguish the metabolomes of overweight and normal-weight runners

AB Nelson, LS Chow, DB Stagg, JR Gillingham… - JCI insight, 2022 - ncbi.nlm.nih.gov
Background Responses of the metabolome to acute aerobic exercise may predict maximum
oxygen consumption (VO 2 max) and longer-term outcomes, including the development of …