Search results for "metabolomics"

Hits ?▲	Authors	Title	Venue	Year	Link
18	Animesh Acharjee, Zsuzsanna Ament, James A. West, Elizabeth Stanley, Julian L. Griffin	Integration of metabolomics, lipidomics and clinical data using a machine learning method.	BMC Bioinform.	2016	DBLP DOI BibTeX RDF
18	Mari van Reenen, Carolus J. Reinecke, Johan A. Westerhuis, J. Hendrik Venter	Variable selection for binary classification using error rate p-values applied to metabolomics data.	BMC Bioinform.	2016	DBLP DOI BibTeX RDF
18	Leonor Puchades-Carrasco, Martina Palomino-Schätzlein, Clara Pérez-Rambla, Antonio Pineda-Lucena	Bioinformatics tools for the analysis of NMR metabolomics studies focused on the identification of clinically relevant biomarkers.	Briefings Bioinform.	2016	DBLP DOI BibTeX RDF
18	Susan K. Van Riper, LeeAnn Higgins, John V. Carlis, Timothy J. Griffin	RIPPER: a framework for MS1 only metabolomics and proteomics label-free relative quantification.	Bioinform.	2016	DBLP DOI BibTeX RDF
18	Azam Yazdani, Akram Yazdani, Ahmad Samiei, Eric Boerwinkle	Identification, analysis, and interpretation of a human serum metabolomics causal network in an observational study.	J. Biomed. Informatics	2016	DBLP DOI BibTeX RDF
18	Xavier Domingo-Almenara, Alexandre Perera, Noelia Ramírez, Jesús Brezmes	Automated resolution of chromatographic signals by independent component analysis-orthogonal signal deconvolution in comprehensive gas chromatography/mass spectrometry-based metabolomics.	Comput. Methods Programs Biomed.	2016	DBLP DOI BibTeX RDF
18	Christopher Costa, Marcelo Maraschin, Miguel Rocha 0001	An R package for the integrated analysis of metabolomics and spectral data.	Comput. Methods Programs Biomed.	2016	DBLP DOI BibTeX RDF
18	Richard Lu, Chieh-Chen Wu, Hsuan-Chia Yang, Yu-Chuan (Jack) Li	Metabolomics processing made easier.	Comput. Methods Programs Biomed.	2016	DBLP DOI BibTeX RDF
18	Zrinka Raguz Nakic, Gerhard Seisenbacher, Francesc Posas, Uwe Sauer	Untargeted metabolomics unravels functionalities of phosphorylation sites in Saccharomyces cerevisiae.	BMC Syst. Biol.	2016	DBLP DOI BibTeX RDF
18	Ting Hu, Weidong Zhang, Zhaozhi Fan, Guang Sun, Sergei Likhodi, Edward Randell, Guangju Zhai	Metabolomics Differential Correlation Network Analysis of Osteoarthritis.	PSB	2016	DBLP BibTeX RDF
18	Jiarui Zhou, Zhen Ji, Zexuan Zhu, Shan He 0001	Metabolomics biomarker discovery using multimodal memetic algorithm and multivariate mutual information based feature selection.	CEC	2016	DBLP DOI BibTeX RDF
18	Clyde F. Phelix, Jason L. Dugan	Integrating information on genomics, transcriptomics, proteomics, and metabolomics into biosimulations for individualized personalized medicine.	BHI	2016	DBLP DOI BibTeX RDF
18	Mohammad Nasir Abdullah, Bee Wah Yap, Yuslina Zakaria, Abu Bakar Abdul Majeed	Metabolites Selection and Classification of Metabolomics Data on Alzheimer's Disease Using Random Forest.	SCDS	2016	DBLP DOI BibTeX RDF
18	Ehsan Ullah, Raghvendra Mall, Reda Rawi, Halima Bensmail	Statistical and Network Analysis of Metabolomics Data.	BCB	2016	DBLP DOI BibTeX RDF
18	Xavier Domingo-Almenara	Automated mass spectrometry-based metabolomics data processing by blind source separation methods.		2016	RDF
18	Anne-Christin Hauschild	Computational methods for breath metabolomics in clinical diagnostics.		2016	RDF
18	Chalini D. Wijetunge	Methods for discovering impartial profiles in metabolomics data.		2016	RDF
18	Nornazliya Mohamad, Rose Ismet, MohdSalleh Rofiee, Zakaria Bannur, Thomas Hennessy, Manikandan Selvaraj, Aminuddin Ahmad, FadzilahMohd Nor, ThuhairahHasrah Abdul Rahman, Kamarudzaman Md. Isa, AdzroolIdzwan Ismail, Lay Teh, Mohd Zaki Salleh	Metabolomics and partial least square discriminant analysis to predict history of myocardial infarction of self-claimed healthy subjects: validity and feasibility for clinical practice.	J. Clin. Bioinform.	2015	DBLP DOI BibTeX RDF
18	Sebastian Böcker, Juho Rousu, Emma Schymanski	Computational Metabolomics (Dagstuhl Seminar 15492).	Dagstuhl Reports	2015	DBLP DOI BibTeX RDF
18	Alexandra Simader, Bernhard Kluger, Nora Katharina Nicole Neumann, Christoph Bueschl, Marc Lemmens, Gerald Lirk, Rudolf Krska, Rainer Schuhmacher	QCScreen: a software tool for data quality control in LC-HRMS based metabolomics.	BMC Bioinform.	2015	DBLP DOI BibTeX RDF
18	Xiang Zhan, Andrew D. Patterson, Debashis Ghosh	Kernel approaches for differential expression analysis of mass spectrometry-based metabolomics data.	BMC Bioinform.	2015	DBLP DOI BibTeX RDF
18	Jasmit S. Shah, Guy N. Brock, Shesh N. Rai	Metabolomics data analysis and missing value issues with application to infarcted mouse hearts.	BMC Bioinform.	2015	DBLP DOI BibTeX RDF
18	Mai Hamdalla, Sanguthevar Rajasekaran, David F. Grant, Ion I. Mandoiu	Metabolic Pathway Predictions for Metabolomics: A Molecular Structure Matching Approach.	J. Chem. Inf. Model.	2015	DBLP DOI BibTeX RDF
18	Jianguo Xia, Igor Sinelnikov, Beomsoo Han, David S. Wishart	MetaboAnalyst 3.0 - making metabolomics more meaningful.	Nucleic Acids Res.	2015	DBLP DOI BibTeX RDF
18	Gengbo Chen, Liang Cui, Guo Shou Teo, Choon Nam Ong, Chuen Seng Tan, Hyungwon Choi	MetTailor: dynamic block summary and intensity normalization for robust analysis of mass spectrometry data in metabolomics.	Bioinform.	2015	DBLP DOI BibTeX RDF
18	Franck Giacomoni, Gildas Le Corguillé, Misharl Monsoor, Marion Landi, Pierre Pericard, Mélanie Pétéra, Christophe Duperier, Marie Tremblay-Franco, Jean-François Martin, Daniel Jacob, Sophie Goulitquer, Etienne A. Thévenot, Christophe Caron	Workflow4Metabolomics: a collaborative research infrastructure for computational metabolomics.	Bioinform.	2015	DBLP DOI BibTeX RDF
18	Enrico Glaab, Reinhard Schneider 0002	RepExplore: addressing technical replicate variance in proteomics and metabolomics data analysis.	Bioinform.	2015	DBLP DOI BibTeX RDF
18	Evrim Acar, Rasmus Bro, Age K. Smilde	Data Fusion in Metabolomics Using Coupled Matrix and Tensor Factorizations.	Proc. IEEE	2015	DBLP DOI BibTeX RDF
18	James G. Jeffryes, Ricardo L. Colastani, Mona Elbadawi-Sidhu, Tobias Kind, Thomas D. Niehaus, Linda J. Broadbelt, Andrew D. Hanson, Oliver Fiehn, Keith E. J. Tyo, Christopher S. Henry	MINEs: open access databases of computationally predicted enzyme promiscuity products for untargeted metabolomics.	J. Cheminformatics	2015	DBLP DOI BibTeX RDF
18	Hélène Blasco, Jerzy Blaszczynski, Jean-Charles Billaut, Lydie Nadal-Desbarats, Pierre-François Pradat, David Devos, Caroline Moreau, Christian R. Andres, Patrick Emond, Philippe Corcia, Roman Slowinski	Comparative analysis of targeted metabolomics: Dominance-based rough set approach versus orthogonal partial least square-discriminant analysis.	J. Biomed. Informatics	2015	DBLP DOI BibTeX RDF
18	Weiruo Zhang, Ritesh Kolte, David L. Dill	Towards in vivo estimation of reaction kinetics using high-throughput metabolomics data: a maximum likelihood approach.	BMC Syst. Biol.	2015	DBLP DOI BibTeX RDF
18	Josep Gómez, Maria Vinaixa, Miguel A. Rodríguez, Reza M. Salek, Xavier Correig, Nicolau Cañellas Alberich	Dolphin 1D: Improving Automation of Targeted Metabolomics in Multi-matrix Datasets of ^1 1 H-NMR Spectra.	PACBB	2015	DBLP DOI BibTeX RDF
18	Xavier Domingo-Almenara, Alexandre Perera, Noelia Ramírez, Jesús Brezmes	Compound Identification in Comprehensive Gas Chromatography - Mass Spectrometry-Based Metabolomics by Blind Source Separation.	PACBB	2015	DBLP DOI BibTeX RDF
18	Christopher Costa, Marcelo Maraschin, Miguel Rocha 0001	An Integrated Computational Platform for Metabolomics Data Analysis.	PACBB	2015	DBLP DOI BibTeX RDF
18	Matthew K. Breitenstein, Richard M. Weinshilboum, Jyotishman Pathak, Liewei Wang	Developing Intermediary Medication Phenotypes via Metabolomics Biotechnology Using an Electronic Health Record-Linked Biobank.	AMIA	2015	DBLP BibTeX RDF
18	Arnald Alonso	Bioinformatics methods for the genomics and metabolomics analysis of immune-mediated inflammatory diseases.		2015	RDF
18	Erhan Kenar	Design and Implementation of Efficient Workflows for Computational Metabolomics		2015	RDF
18	Robert Smith 0001, Andrew D. Mathis, Dan Ventura, John T. Prince	Proteomics, lipidomics, metabolomics: a mass spectrometry tutorial from a computer scientist's point of view.	BMC Bioinform.	2014	DBLP DOI BibTeX RDF
18	Stephen C. Grace, Stephen Embry, Heng Luo 0002	Haystack, a web-based tool for metabolomics research.	BMC Bioinform.	2014	DBLP DOI BibTeX RDF
18	Joshua M. Mitchell, Teresa W.-M. Fan, Andrew N. Lane, Hunter N. B. Moseley	Development of large-scale metabolite identification methods for metabolomics.	BMC Bioinform.	2014	DBLP DOI BibTeX RDF
18	Wenchao Zhang, Patrick Xuechun Zhao	Quality evaluation of extracted ion chromatograms and chromatographic peaks in liquid chromatography/mass spectrometry-based metabolomics data.	BMC Bioinform.	2014	DBLP DOI BibTeX RDF
18	Paulo Vieira Milreu, Cecilia Coimbra Klein, Ludovic Cottret, Vicente Acuña, Etienne Birmelé, Michele Borassi, Christophe Junot, Alberto Marchetti-Spaccamela, Andrea Marino 0001, Leen Stougie, Fabien Jourdan, Pierluigi Crescenzi, Vincent Lacroix, Marie-France Sagot	Telling metabolic stories to explore metabolomics data: a case study on the yeast response to cadmium exposure.	Bioinform.	2014	DBLP DOI BibTeX RDF
18	Hiroshi Tsugawa, Mitsuhiro Kanazawa, Atsushi Ogiwara, Masanori Arita	MRMPROBS suite for metabolomics using large-scale MRM assays.	Bioinform.	2014	DBLP DOI BibTeX RDF
18	Ricardo Roberto da Silva, Fabien Jourdan, Diego M. Salvanha, Fabien Létisse, Emilien L. Jamin, Simone Guidetti-Gonzalez, Carlos A. Labate, Ricardo Z. N. Vêncio	ProbMetab: an R package for Bayesian probabilistic annotation of LC-MS-based metabolomics.	Bioinform.	2014	DBLP DOI BibTeX RDF
18	Alexandra Jauhiainen, Basetti Madhu, Masako Narita, Masashi Narita, John Griffiths, Simon Tavaré	Normalization of metabolomics data with applications to correlation maps.	Bioinform.	2014	DBLP DOI BibTeX RDF
18	Michael Nodzenski, Michael J. Muehlbauer, James R. Bain, Anna C. Reisetter, William L. Lowe Jr., Denise M. Scholtens	Metabomxtr: an R package for mixture-model analysis of non-targeted metabolomics data.	Bioinform.	2014	DBLP DOI BibTeX RDF
18	Tommi Suvitaival, Simon Rogers, Samuel Kaski	Stronger findings for metabolomics through Bayesian modeling of multiple peaks and compound correlations.	Bioinform.	2014	DBLP DOI BibTeX RDF
18	Hongjie Zhu, Man Luo	Chemical structure informing statistical hypothesis testing in metabolomics.	Bioinform.	2014	DBLP DOI BibTeX RDF
18	Tianwei Yu, Dean P. Jones	Improving peak detection in high-resolution LC/MS metabolomics data using preexisting knowledge and machine learning approach.	Bioinform.	2014	DBLP DOI BibTeX RDF
18	Francesc Fernández-Albert, Rafael Llorach, Mar Garcia-Aloy, Andrey Ziyatdinov, Cristina Andres-Lacueva, Alexandre Perera-Lluna	Intensity drift removal in LC/MS metabolomics by common variance compensation.	Bioinform.	2014	DBLP DOI BibTeX RDF
18	Siamak Ravanbakhsh, Philip Liu, Trent C. Bjorndahl, Rupasri Mandal, Jason R. Grant, Michael Wilson 0002, Roman Eisner, Igor Sinelnikov, Xiaoyu Hu, Claudio Luchinat, Russell Greiner, David S. Wishart	Accurate, fully-automated NMR spectral profiling for metabolomics.	CoRR	2014	DBLP BibTeX RDF
18	Jean-Eudes J. Dazard, Yana Sandlers, Stephanie K. Doerner, Nathan A. Berger, Henri Brunengraber	Metabolomics of Apc Min/+ mice genetically susceptible to intestinal cancer.	BMC Syst. Biol.	2014	DBLP DOI BibTeX RDF
18	Polina Reshetova, Age K. Smilde, Antoine H. C. van Kampen, Johan A. Westerhuis	Use of prior knowledge for the analysis of high-throughput transcriptomics and metabolomics data.	BMC Syst. Biol.	2014	DBLP DOI BibTeX RDF
18	Scott MacKay, Jie Chen 0002	Biosensor systems and applications in genomics, proteomics and metabolomics: A review.	ISCAS	2014	DBLP DOI BibTeX RDF
18	Sidrah Anjum, Attya Bhatti, Asma Gul	In-silico approaches to sequence and structure based scrutiny of nonsynonymous SNPs and synteny of ACAA2 for its implicated role in metabolomics.	IWBBIO	2014	DBLP BibTeX RDF
18	Trung-Nghia Vu	Intelligent analysis and data mining of spectral data in proteomics ans metabolomics		2014	RDF
18	Stephan Beisken	Informatics for tandem mass spectrometry-based metabolomics.		2014	RDF
18	Francesc Fernández-Albert	Machine learning methods for the analysis of liquid chromatography-mass spectrometry datasets in metabolomics.		2014	RDF
18	Patrick-Denis St-Coeur, Mohamed Touaibia, Miroslava Cuperlovic-Culf, Pier Jr Morin	Leveraging Metabolomics to Assess the Next Generation of Temozolomide-based Therapeutic Approaches for Glioblastomas.	Genom. Proteom. Bioinform.	2013	DBLP DOI BibTeX RDF
18	Jaesik Jeong, Xiang Zhang 0003, Xue Shi, Seongho Kim, Changyu Shen	An efficient post-hoc integration method improving peak alignment of metabolomics data from GCxGC/TOF-MS.	BMC Bioinform.	2013	DBLP DOI BibTeX RDF
18	Karan Uppal, Quinlyn A. Soltow, Frederick H. Strobel, W. Stephen Pittard, Kim M. Gernert, Tianwei Yu, Dean P. Jones	xMSanalyzer: automated pipeline for improved feature detection and downstream analysis of large-scale, non-targeted metabolomics data.	BMC Bioinform.	2013	DBLP DOI BibTeX RDF
18	Lochana C. Menikarachchi, Dennis W. Hill, Mai Hamdalla, Ion I. Mandoiu, David F. Grant	In Silico Enzymatic Synthesis of a 400 000 Compound Biochemical Database for Nontargeted Metabolomics.	J. Chem. Inf. Model.	2013	DBLP DOI BibTeX RDF
18	Mai Hamdalla, Ion I. Mandoiu, Dennis W. Hill, Sanguthevar Rajasekaran, David F. Grant	BioSM: Metabolomics Tool for Identifying Endogenous Mammalian Biochemical Structures in Chemical Structure Space.	J. Chem. Inf. Model.	2013	DBLP DOI BibTeX RDF
18	Michael Snyder 0001, George Mias, Larissa Stanberry, Eugene Kolker	Metadata Checklist for the Integrated Personal Omics Study: Proteomics and Metabolomics Experiments.	Big Data	2013	DBLP DOI BibTeX RDF
18	Reza M. Salek, Kenneth Haug, Pablo Conesa, Janna Hastings, Mark Williams, Tejasvi Mahendraker, Eamonn Maguire, Alejandra N. González-Beltrán, Philippe Rocca-Serra, Susanna-Assunta Sansone, Christoph Steinbeck	The MetaboLights repository: curation challenges in metabolomics.	Database J. Biol. Databases Curation	2013	DBLP DOI BibTeX RDF
18	Kenneth Haug, Reza M. Salek, Pablo Conesa, Janna Hastings, Paula de Matos, Mark Rijnbeek, Tejasvi Mahendraker, Mark Williams, Steffen Neumann, Philippe Rocca-Serra, Eamonn Maguire, Alejandra N. González-Beltrán, Susanna-Assunta Sansone, Julian L. Griffin, Christoph Steinbeck	MetaboLights - an open-access general-purpose repository for metabolomics studies and associated meta-data.	Nucleic Acids Res.	2013	DBLP DOI BibTeX RDF
18	Nikolas Kessler, Heiko Neuweger, Anja Bonte, Georg Langenkämper, Karsten Niehaus, Tim W. Nattkemper, Alexander Goesmann	MeltDB 2.0-advances of the metabolomics software system.	Bioinform.	2013	DBLP DOI BibTeX RDF
18	Xiaoli Wei, Xue Shi, Imhoi Koo, Seongho Kim, Robin H. Schmidt, Gavin E. Arteel, Walter H. Watson, Craig McClain, Xiang Zhang 0003	MetPP: a computational platform for comprehensive two-dimensional gas chromatography time-of-flight mass spectrometry-based metabolomics.	Bioinform.	2013	DBLP DOI BibTeX RDF
18	Brian J. Schmidt, Ali Ebrahim, Thomas O. Metz, Joshua N. Adkins, Bernhard Ø. Palsson, Daniel R. Hyduke	GIM3E: condition-specific models of cellular metabolism developed from metabolomics and expression data.	Bioinform.	2013	DBLP DOI BibTeX RDF
18	Shuzhao Li, Youngja Park, Sai Duraisingham, Frederick H. Strobel, Nooruddin Khan, Quinlyn A. Soltow, Dean P. Jones, Bali Pulendran	Predicting Network Activity from High Throughput Metabolomics.	PLoS Comput. Biol.	2013	DBLP DOI BibTeX RDF
18	Helen L. Kotze, Emily G. Armitage, Kieran J. Sharkey, James William Allwood, Warwick B. Dunn, Kaye J. Williams, Royston Goodacre	A novel untargeted metabolomics correlation-based network analysis incorporating human metabolic reconstructions.	BMC Syst. Biol.	2013	DBLP DOI BibTeX RDF
18	Joel Jordà, Camilo Suarez, Marc Carnicer, Angela ten Pierick, Joseph J. Heijnen, Walter M. van Gulik, Pau Ferrer, Joan Albiol, Aljoscha Wahl	Glucose-methanol co-utilization in Pichia pastoris studied by metabolomics and instationary 13C flux analysis.	BMC Syst. Biol.	2013	DBLP DOI BibTeX RDF
18	Evrim Acar, Anders J. Lawaetz, Morten A. Rasmussen, Rasmus Bro	Structure-revealing data fusion model with applications in metabolomics.	EMBC	2013	DBLP DOI BibTeX RDF
18	Evrim Acar, Gozde Gürdeniz, Morten A. Rasmussen, Daniela Rago, Lars O. Dragsted, Rasmus Bro	Coupled Matrix Factorization with Sparse Factors to Identify Potential Biomarkers in Metabolomics.	Int. J. Knowl. Discov. Bioinform.	2012	DBLP DOI BibTeX RDF
18	Philip Livengood, Ross Maciejewski, Wei Chen 0001, David S. Ebert	OmicsVis: an interactive tool for visually analyzing metabolomics data.	BMC Bioinform.	2012	DBLP DOI BibTeX RDF
18	Humberto González Díaz, Pablo Riera-Fernández	New Markov-Autocorrelation Indices for Re-evaluation of Links in Chemical and Biological Complex Networks used in Metabolomics, Parasitology, Neurosciences, and Epidemiology.	J. Chem. Inf. Model.	2012	DBLP DOI BibTeX RDF
18	L. Mark Hall, Lowell H. Hall, Tzipporah M. Kertesz, Dennis W. Hill, Thomas R. Sharp, Edward Z. Oblak, Ying W. Dong, David S. Wishart, Ming-Hui Chen, David F. Grant	Development of Ecom50 and Retention Index Models for Nontargeted Metabolomics: Identification of 1, 3-Dicyclohexylurea in Human Serum by HPLC/Mass Spectrometry.	J. Chem. Inf. Model.	2012	DBLP DOI BibTeX RDF
18	Preeti Bais, Stephanie M. Moon-Quanbeck, Basil J. Nikolau, Julie A. Dickerson	Plantmetabolomics.org: mass spectrometry-based Arabidopsis metabolomics - database and tools update.	Nucleic Acids Res.	2012	DBLP DOI BibTeX RDF
18	Miguel Rojas-Chertó, Michael van Vliet, Julio E. Peironcely, Ronnie van Doorn, Maarten Kooyman, Tim te Beek, Marc A. van Driel, Thomas Hankemeier, Theo H. Reijmers	MetiTree: a web application to organize and process high-resolution multi-stage mass spectrometry metabolomics data.	Bioinform.	2012	DBLP DOI BibTeX RDF
18	Alla Karnovsky, Terry E. Weymouth, Tim Hull, V. Glenn Tarcea, Giovanni Scardoni, Carlo Laudanna, Maureen A. Sartor, Kathleen A. Stringer, H. V. Jagadish, Charles F. Burant, Brian D. Athey, Gilbert S. Omenn	Metscape 2 bioinformatics tool for the analysis and visualization of metabolomics and gene expression data.	Bioinform.	2012	DBLP DOI BibTeX RDF
18	Christoph Bueschl, Bernhard Kluger, Franz Berthiller, Gerald Lirk, Stephan Winkler 0001, Rudolf Krska, Rainer Schuhmacher	MetExtract: a new software tool for the automated comprehensive extraction of metabolite-derived LC/MS signals in metabolomics research.	Bioinform.	2012	DBLP DOI BibTeX RDF
18	Darren J. Creek, Andris Jankevics, Karl E. V. Burgess, Rainer Breitling, Michael P. Barrett	IDEOM: an Excel interface for analysis of LC-MS-based metabolomics data.	Bioinform.	2012	DBLP DOI BibTeX RDF
18	Ali Cakmak 0001, Xinjian Qi, A. Ercüment Çiçek, Ilya Bederman, Leigh Henderson, Mitchell L. Drumm, Gultekin Özsoyoglu	A New metabolomics Analysis Technique: steady-State metabolic Network Dynamics Analysis.	J. Bioinform. Comput. Biol.	2012	DBLP DOI BibTeX RDF
18	Xianfu Gao, Wanjia Chen, Rongxia Li, Minfeng Wang, Chunlei Chen, Rong Zeng, Yueyi Deng	Systematic variations associated with renal disease uncovered by parallel metabolomics of urine and serum.	BMC Syst. Biol.	2012	DBLP DOI BibTeX RDF
18	Evrim Acar, Gozde Gürdeniz, Morten A. Rasmussen, Daniela Rago, Lars O. Dragsted, Rasmus Bro	Coupled Matrix Factorization with Sparse Factors to Identify Potential Biomarkers in Metabolomics.	ICDM Workshops	2012	DBLP DOI BibTeX RDF
18	Marcelo Maraschin, Amélia Somensi-Zeggio, Simone K. Oliveira, Shirley Kuhnen, Maíra M. Tomazzoli, Ana C. M. Zeri, Rafael Carreira, Miguel Rocha 0001	A Machine Learning and Chemometrics Assisted Interpretation of Spectroscopic Data - A NMR-Based Metabolomics Platform for the Assessment of Brazilian Propolis.	PRIB	2012	DBLP DOI BibTeX RDF
18	Michael Biehl, Petra Schneider, David Smith, Han Stiekema, Angela Taylor, Beverly Hughes, Cedric Shackleton, Paul Stewart, Wiebke Arlt	Matrix relevance LVQ in steroid metabolomics based classification of adrenal tumors.	ESANN	2012	DBLP BibTeX RDF
18	Xiaoli Wei, Xue Shi, Seongho Kim, Craig McClain, Xiang Zhang 0003	A Novel Two-Stage Alignment Method for Liquid Chromatography Mass Spectrometry-Based Metabolomics.	ICIC (1)	2012	DBLP DOI BibTeX RDF
18	Mai Hamdalla, David F. Grant, Ion I. Mandoiu, Dennis W. Hill, Sanguthevar Rajasekaran, Reda A. Ammar	The use of graph matching algorithms to identify biochemical substructures in synthetic chemical compounds: Application to metabolomics.	ICCABS	2012	DBLP DOI BibTeX RDF
18	Edward Pharr, Aspen Olmsted, Paul E. Anderson 0001	gLIMS: Google cloud-based laboratory information management system for NMR metabolomics.	BCB	2012	DBLP DOI BibTeX RDF
18	Ahmed BaniMustafa	A knowledge discovery and data mining process model for metabolomics.		2012	RDF
18	Jon Pey, Constantinos Theodoropoulos, Alberto Rezola, Angel Rubio, Marta Cascante, Francisco J. Planes	Do elementary flux modes combine linearly at the "atomic" level? Integrating tracer-based metabolomics data and elementary flux modes.	Biosyst.	2011	DBLP DOI BibTeX RDF
18	Elon Santos Correa, Royston Goodacre	A genetic algorithm-Bayesian network approach for the analysis of metabolomics and spectroscopic data: application to the rapid detection of Bacillus spores and identification of Bacillus species.	BMC Bioinform.	2011	DBLP DOI BibTeX RDF
18	Hiroshi Tsugawa, Yuki Tsujimot, Masanori Arita, Takeshi Bamba, Eiichiro Fukusaki	GC/MS Based Metabolomics: Development of a Data Mining System for Metabolite Identification by using Soft Independent Modeling of Class Analogy (SIMCA).	BMC Bioinform.	2011	DBLP DOI BibTeX RDF
18	Christian Ludwig, Ulrich L. Günther	MetaboLab - advanced NMR data processing and analysis for metabolomics.	BMC Bioinform.	2011	DBLP DOI BibTeX RDF
18	Lionel Blanchet, Agnieszka Smolinska, Amos Attali, Marcel P. Stoop, Kirsten A. M. Ampt, Hans van Aken, Ernst Suidgeest, Tinka Tuinstra, Sybren S. Wijmenga, Theo Luider, Lutgarde M. C. Buydens	Fusion of metabolomics and proteomics data for biomarkers discovery: case study on the experimental autoimmune encephalomyelitis.	BMC Bioinform.	2011	DBLP DOI BibTeX RDF
18	Fernando García-Alcalde, Federico García-López, Joaquín Dopazo, Ana Conesa	Paintomics: a web based tool for the joint visualization of transcriptomics and metabolomics data.	Bioinform.	2011	DBLP DOI BibTeX RDF
18	Atanas Kamburov, Rachel Cavill, Timothy M. D. Ebbels, Ralf Herwig, Hector C. Keun	Integrated pathway-level analysis of transcriptomics and metabolomics data with IMPaLA.	Bioinform.	2011	DBLP DOI BibTeX RDF
18	Genevera I. Allen, Mirjana Maletic-Savatic	Sparse non-negative generalized PCA with applications to metabolomics.	Bioinform.	2011	DBLP DOI BibTeX RDF
18	Francesca Chignola, Silvia Mari, Tim J. Stevens, Rasmus H. Fogh, Valeria Mannella, Wayne Boucher, Giovanna Musco	The CCPN Metabolomics Project: a fast protocol for metabolite identification by 2D-NMR.	Bioinform.	2011	DBLP DOI BibTeX RDF