Analytic properties of statistical total correlation spectroscopy based information recovery in 1H NMR metabolic data sets

Analytical Chemistry

Volumn 81, Issue 6, 2009, Pages 2075-2084

  Alves, Alexessander Couto ^a   Rantalainen, Mattias ^a   Holmes, Elaine ^a   Nicholson, Jeremy K ^a   Ebbels, Timothy M D ^a  

^a Faculty of Medicine   (United Kingdom)

Author keywords

[No Author keywords available]

Indexed keywords

ANALYTIC PROPERTIES; AREA UNDER THE CURVES; BOOTSTRAP RE SAMPLINGS; COMPLEX MIXTURE ANALYSIS; CORRELATION THRESHOLDS; DATA SETS; DEGREE OF CORRELATIONS; H NMR SPECTRUM; HIGH PROBABILITIES; INFORMATION RECOVERIES; MATRIXES; METABOLIC DATUM; METABOLIC PROFILING; NMR SPECTROSCOPIES; NON-STATIONARY PROCESS; PEAK POSITIONS; POSITIVE PREDICTIVE VALUES; RAT URINES; RECEIVER OPERATING CHARACTERISTICS; SAMPLE SIZES; SENSITIVITY AND SPECIFICITIES; SMALL MOLECULES; STATISTICAL DISTRIBUTIONS; STATISTICAL TOTAL CORRELATION SPECTROSCOPIES; STRUCTURAL ASSIGNMENTS; STRUCTURAL CHARACTERIZATIONS; STRUCTURAL CONNECTIVITIES; STRUCTURAL CORRELATIONS;

BIOCHEMISTRY; BODY FLUIDS; CORRELATION METHODS; METABOLISM; METABOLITES; NUCLEAR MAGNETIC RESONANCE; NUCLEAR MAGNETIC RESONANCE SPECTROSCOPY; PHYSIOLOGICAL MODELS; PROBABILITY; PROBABILITY DENSITY FUNCTION;

SPECTROSCOPIC ANALYSIS;

TOXIN;

ARTICLE; BOOTSTRAPPING; CONTROLLED STUDY; MALE; NONHUMAN; PHYSIOLOGICAL STRESS; PROTON NUCLEAR MAGNETIC RESONANCE; RAT; SAMPLE SIZE; SENSITIVITY AND SPECIFICITY; SPECTROSCOPY; STATISTICAL TOTAL CORRELATION SPECTROSCOPY; URINALYSIS;

ANIMALS; AREA UNDER CURVE; MAGNETIC RESONANCE SPECTROSCOPY; MALE; METABOLOME; RATS; RATS, SPRAGUE-DAWLEY; ROC CURVE; TOXINS, BIOLOGICAL; URINALYSIS;

EID: 64649084089     PISSN: 00032700     EISSN: None     Source Type: Journal    
DOI: 10.1021/ac801982h     Document Type: Article

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