articlePLoS Computational BiologyJul 4, 2013GOLD OA

Predicting Network Activity from High Throughput Metabolomics

Emory University · Emory University Orthopaedics and Spine Hospital · +2 more institutions

PubMed
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Abstract

The functional interpretation of high throughput metabolomics by mass spectrometry is hindered by the identification of metabolites, a tedious and challenging task. We present a set of computational algorithms which, by leveraging the collective power of metabolic pathways and networks, predict functional activity directly from spectral feature tables without a priori identification of metabolites. The algorithms were experimentally validated on the activation of innate immune cells.

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Authors

8

Topics & keywords

Keywords
  • Metabolomics
  • Identification (biology)
  • Computer science
  • Throughput
  • Computational biology
  • A priori and a posteriori
  • Set (abstract data type)
  • Task (project management)
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