NMR-based metabonomic toxicity classification: Hierarchical cluster analysis and k-nearest-neighbour approaches

Analytica Chimica Acta

Volumn 490, Issue 1-2, 2003, Pages 3-15

  Beckonert, Olaf ^a   Bollard, Mary E ^a   Ebbels, Timothy M D ^a   Keun, Hector C ^a   Antti, Henrik ^a   Holmes, Elaine ^a   Lindon, John C ^a   Nicholson, Jeremy K ^a  

^a IMPERIAL COLLEGE LONDON   (United Kingdom)

Author keywords

Biofluid; Hierarchical cluster analysis; k Nearest neighbour; Metabonomics; NMR; Partial least squares discriminant analysis; Principal component analysis; Toxicity prediction; Urine

Indexed keywords

DRUG INTERACTIONS; METABOLISM; NUCLEAR MAGNETIC RESONANCE; TOXIC MATERIALS;

DRUG TOXICITY;

TOXICITY;

TOXIN;

ANIMAL EXPERIMENT; ANIMAL MODEL; CLUSTER ANALYSIS; CONFERENCE PAPER; CONTROLLED STUDY; KIDNEY; LIVER; MALE; MULTIVARIATE ANALYSIS; NONHUMAN; PREDICTION; PRINCIPAL COMPONENT ANALYSIS; PRIORITY JOURNAL; PROTON NUCLEAR MAGNETIC RESONANCE; RAT; TOXICITY; URINALYSIS;

ANIMALIA;

EID: 0142039110     PISSN: 00032670     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0003-2670(03)00060-6     Document Type: Conference Paper

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