Analytical Methods in Untargeted Metabolomics: State of the Art in 2015, Frontiers in Bioengineering and Biotechnology, vol.38, issue.23, 2015. ,
DOI : 10.1016/j.jkss.2008.10.007
Quantitative 1H NMR spectroscopy, TrAC Trends in Analytical Chemistry, vol.35, pp.5-26, 2012. ,
DOI : 10.1016/j.trac.2012.02.007
Improved parametric time warping for proteomics, Chemometrics and Intelligent Laboratory Systems, vol.104, issue.1, pp.65-74, 2010. ,
DOI : 10.1016/j.chemolab.2010.04.008
Highly Repeatable Dissolution Dynamic Nuclear Polarization for Heteronuclear NMR Metabolomics, Analytical Chemistry, vol.88, issue.12, pp.88-6179, 2016. ,
DOI : 10.1021/acs.analchem.6b01094
URL : https://hal.archives-ouvertes.fr/hal-01366193
Virtual Research Environments: An Overview and a Research Agenda, Data Science Journal, vol.12, issue.0, 2013. ,
DOI : 10.1126/science.8346438
URL : http://doi.org/10.2481/dsj.grdi-013
H NMR Data Sets, Analytical Chemistry, vol.77, issue.5, pp.77-1282, 2005. ,
DOI : 10.1021/ac048630x
1H NMR Analysis of Cerebrospinal Fluid from Alzheimer???s Disease Patients: An Example of a Possible Misinterpretation Due to Non-Adjustment of pH, Metabolites, vol.4, issue.1, pp.115-12810, 2014. ,
DOI : 10.3390/metabo4010115
NMR-Based Characterization of Metabolic Alterations in Hypertension Using an Adaptive, Intelligent Binning Algorithm, Analytical Chemistry, vol.80, issue.10, pp.80-3783, 2008. ,
DOI : 10.1021/ac7025964
Rcpp: Seamless R and C++ Integration, Journal of Statistical Software, issue.8, pp.40-41, 2011. ,
DOI : 10.1007/978-1-4614-6868-4
URL : http://doi.org/10.18637/jss.v040.i08
Workflow4Metabolomics: a collaborative research infrastructure for computational metabolomics, Bioinformatics, vol.31, issue.9, pp.1493-1495, 2015. ,
DOI : 10.1093/bioinformatics/btu813
URL : https://hal.archives-ouvertes.fr/hal-01123263
NMR Spectroscopy for Metabolomics and Metabolic Profiling, Analytical Chemistry, vol.87, issue.1, pp.133-146, 2015. ,
DOI : 10.1021/ac504075g
Data standards can boost metabolomics research, and if there is a will, there is a way, Metabolomics, vol.32, issue.3, pp.14-24, 2016. ,
DOI : 10.1007/s11306-015-0879-3
URL : https://hal.archives-ouvertes.fr/hal-01232411
Modelling the acid/base 1 H NMR chemical shift limits of metabolites in human urine Getting Your Peaks in Line: A Review of Alignment Methods for NMR Spectral Data, Metabolomics Metabolites, vol.12, issue.32, pp.259-276, 2013. ,
MetaboAnalyst 3.0???making metabolomics more meaningful, Nucleic Acids Research, vol.43, issue.W1, pp.251-257, 2015. ,
DOI : 10.1093/nar/gkv380
URL : http://doi.org/10.1093/nar/gkv380