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Other literature type . 2025
License: CC BY
Data sources: ZENODO
ZENODO
Conference object . 2025
License: CC BY
Data sources: Datacite
ZENODO
Conference object . 2025
License: CC BY
Data sources: Datacite
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Decoding health from NMR spectra: machine learning models for metabolic health

Authors: Ibáñez de Opakua López de Abetxuko, Alain;

Decoding health from NMR spectra: machine learning models for metabolic health

Abstract

This poster presents an integrated machine-learning framework for decoding metabolic health from large-scale NMR metabolomics data, combining 1D ¹H NOESY spectra, fast 2D J-resolved experiments, quantified metabolites, and predicted clinical parameters to assess biological age and classify disease states. Using over 30,000 serum samples, the approach achieves highly accurate metabolic age estimation (R = 0.92) and robust multiclass disease classification across nine health categories (accuracy = 0.80, AUC = 0.91–1.00). Analyses of metabolic age distortion reveal disease-associated physiological alterations, while SHAP-based interpretation highlights the relevance of inflammatory and metabolic stability markers. The framework also enables individualized diagnostic reports, illustrating its potential as a scalable, non-invasive tool for precision metabolic phenotyping and personalized health monitoring.

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selected citations
These citations are derived from selected sources.
This is an alternative to the "Influence" indicator, which also reflects the overall/total impact of an article in the research community at large, based on the underlying citation network (diachronically).
BIP!Citations provided by BIP!
popularity
This indicator reflects the "current" impact/attention (the "hype") of an article in the research community at large, based on the underlying citation network.
BIP!Popularity provided by BIP!
influence
This indicator reflects the overall/total impact of an article in the research community at large, based on the underlying citation network (diachronically).
BIP!Influence provided by BIP!
impulse
This indicator reflects the initial momentum of an article directly after its publication, based on the underlying citation network.
BIP!Impulse provided by BIP!
0
Average
Average
Average