The influence of scaling metabolomics data on model classification accuracy

A comparative investigation of modern feature selection and classification approaches for the analysis of mass spectrometry data

(2014) Piotr S. Gromski et al.   ANALYTICA CHIMICA ACTA

Metabolomics in melon: A new opportunity for aroma analysis

(2014) J. William Allwood et al.   PHYTOCHEMISTRY

Metabolomics and metabolite profiling

(2013) Rainer Schuhmacher et al.   ANALYTICAL AND BIOANALYTICAL CHEMISTRY

Metabolomics and systems pharmacology: why and how to model the human metabolic network for drug discovery

(2013) Douglas B. Kell et al.   DRUG DISCOVERY TODAY

The role of reporting standards for metabolite annotation and identification in metabolomic studies

(2013) Reza M Salek et al.   GigaScience

Analysis of human urine reveals metabolic changes related to the development of acute kidney injury following cardiac surgery

(2012) Helena U. Zacharias et al.   Metabolomics

MetaboLights—an open-access general-purpose repository for metabolomics studies and associated meta-data

(2012) Kenneth Haug et al.   NUCLEIC ACIDS RESEARCH

Metabolic fingerprinting as a tool to monitor whole-cell biotransformations

(2010) Catherine L. Winder et al.   ANALYTICAL AND BIOANALYTICAL CHEMISTRY

The role of metabolites and metabolomics in clinically applicable biomarkers of disease

(2010) Mamas Mamas et al.   ARCHIVES OF TOXICOLOGY

Systems level studies of mammalian metabolomes: the roles of mass spectrometry and nuclear magnetic resonance spectroscopy

(2010) Warwick B. Dunn et al.   CHEMICAL SOCIETY REVIEWS

Multivariate paired data analysis: multilevel PLSDA versus OPLSDA

(2009) Johan A. Westerhuis et al.   Metabolomics

Discriminant Q2 (DQ2) for improved discrimination in PLSDA models

(2008) Johan A. Westerhuis et al.   Metabolomics