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Data Streaming for Metabolomics: Accelerating Data Processing and Analysis from Days to Minutes

[Image: see text] The speed and throughput of analytical platforms has been a driving force in recent years in the “omics” technologies and while great strides have been accomplished in both chromatography and mass spectrometry, data analysis times have not benefited at the same pace. Even though pe...

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Autores principales: Montenegro-Burke, J. Rafael, Aisporna, Aries E., Benton, H. Paul, Rinehart, Duane, Fang, Mingliang, Huan, Tao, Warth, Benedikt, Forsberg, Erica, Abe, Brian T., Ivanisevic, Julijana, Wolan, Dennis W., Teyton, Luc, Lairson, Luke, Siuzdak, Gary
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2016
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5244434/
https://www.ncbi.nlm.nih.gov/pubmed/27983788
http://dx.doi.org/10.1021/acs.analchem.6b03890
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author Montenegro-Burke, J. Rafael
Aisporna, Aries E.
Benton, H. Paul
Rinehart, Duane
Fang, Mingliang
Huan, Tao
Warth, Benedikt
Forsberg, Erica
Abe, Brian T.
Ivanisevic, Julijana
Wolan, Dennis W.
Teyton, Luc
Lairson, Luke
Siuzdak, Gary
author_facet Montenegro-Burke, J. Rafael
Aisporna, Aries E.
Benton, H. Paul
Rinehart, Duane
Fang, Mingliang
Huan, Tao
Warth, Benedikt
Forsberg, Erica
Abe, Brian T.
Ivanisevic, Julijana
Wolan, Dennis W.
Teyton, Luc
Lairson, Luke
Siuzdak, Gary
author_sort Montenegro-Burke, J. Rafael
collection PubMed
description [Image: see text] The speed and throughput of analytical platforms has been a driving force in recent years in the “omics” technologies and while great strides have been accomplished in both chromatography and mass spectrometry, data analysis times have not benefited at the same pace. Even though personal computers have become more powerful, data transfer times still represent a bottleneck in data processing because of the increasingly complex data files and studies with a greater number of samples. To meet the demand of analyzing hundreds to thousands of samples within a given experiment, we have developed a data streaming platform, XCMS Stream, which capitalizes on the acquisition time to compress and stream recently acquired data files to data processing servers, mimicking just-in-time production strategies from the manufacturing industry. The utility of this XCMS Online-based technology is demonstrated here in the analysis of T cell metabolism and other large-scale metabolomic studies. A large scale example on a 1000 sample data set demonstrated a 10 000-fold time savings, reducing data analysis time from days to minutes. Further, XCMS Stream has the capability to increase the efficiency of downstream biochemical dependent data acquisition (BDDA) analysis by initiating data conversion and data processing on subsets of data acquired, expanding its application beyond data transfer to smart preliminary data decision-making prior to full acquisition.
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spelling pubmed-52444342017-01-23 Data Streaming for Metabolomics: Accelerating Data Processing and Analysis from Days to Minutes Montenegro-Burke, J. Rafael Aisporna, Aries E. Benton, H. Paul Rinehart, Duane Fang, Mingliang Huan, Tao Warth, Benedikt Forsberg, Erica Abe, Brian T. Ivanisevic, Julijana Wolan, Dennis W. Teyton, Luc Lairson, Luke Siuzdak, Gary Anal Chem [Image: see text] The speed and throughput of analytical platforms has been a driving force in recent years in the “omics” technologies and while great strides have been accomplished in both chromatography and mass spectrometry, data analysis times have not benefited at the same pace. Even though personal computers have become more powerful, data transfer times still represent a bottleneck in data processing because of the increasingly complex data files and studies with a greater number of samples. To meet the demand of analyzing hundreds to thousands of samples within a given experiment, we have developed a data streaming platform, XCMS Stream, which capitalizes on the acquisition time to compress and stream recently acquired data files to data processing servers, mimicking just-in-time production strategies from the manufacturing industry. The utility of this XCMS Online-based technology is demonstrated here in the analysis of T cell metabolism and other large-scale metabolomic studies. A large scale example on a 1000 sample data set demonstrated a 10 000-fold time savings, reducing data analysis time from days to minutes. Further, XCMS Stream has the capability to increase the efficiency of downstream biochemical dependent data acquisition (BDDA) analysis by initiating data conversion and data processing on subsets of data acquired, expanding its application beyond data transfer to smart preliminary data decision-making prior to full acquisition. American Chemical Society 2016-12-16 2017-01-17 /pmc/articles/PMC5244434/ /pubmed/27983788 http://dx.doi.org/10.1021/acs.analchem.6b03890 Text en Copyright © 2016 American Chemical Society This is an open access article published under an ACS AuthorChoice License (http://pubs.acs.org/page/policy/authorchoice_termsofuse.html) , which permits copying and redistribution of the article or any adaptations for non-commercial purposes.
spellingShingle Montenegro-Burke, J. Rafael
Aisporna, Aries E.
Benton, H. Paul
Rinehart, Duane
Fang, Mingliang
Huan, Tao
Warth, Benedikt
Forsberg, Erica
Abe, Brian T.
Ivanisevic, Julijana
Wolan, Dennis W.
Teyton, Luc
Lairson, Luke
Siuzdak, Gary
Data Streaming for Metabolomics: Accelerating Data Processing and Analysis from Days to Minutes
title Data Streaming for Metabolomics: Accelerating Data Processing and Analysis from Days to Minutes
title_full Data Streaming for Metabolomics: Accelerating Data Processing and Analysis from Days to Minutes
title_fullStr Data Streaming for Metabolomics: Accelerating Data Processing and Analysis from Days to Minutes
title_full_unstemmed Data Streaming for Metabolomics: Accelerating Data Processing and Analysis from Days to Minutes
title_short Data Streaming for Metabolomics: Accelerating Data Processing and Analysis from Days to Minutes
title_sort data streaming for metabolomics: accelerating data processing and analysis from days to minutes
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5244434/
https://www.ncbi.nlm.nih.gov/pubmed/27983788
http://dx.doi.org/10.1021/acs.analchem.6b03890
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