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  4. Tandem Mass Spectrometry Protein Identification on a PC Grid
 
conference paper

Tandem Mass Spectrometry Protein Identification on a PC Grid

Zosso, Dominique  
•
Podvinec, Michael
•
Müller, Markus
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2007
From Genes to Personalized HealthCare: Grid Solutions for the Life Sciences - Proceedings of HealthGrid 2007
5th HealthGrid Conference

We present a method to grid-enable tandem mass spectrometry protein identification. The implemented parallelization strategy embeds the open-source x!tandem tool in a grid-enabled workflow. This allows rapid analysis of largescale mass spectrometry experiments on existing heterogeneous hardware. We have explored different data-splitting schemes, considering both splitting spectra datasets and protein databases, and examine the impact of the different schemes on scoring and computation time. While resulting peptide e-values exhibit fluctuation, we show that these variations are small, caused by statistical rather than numerical instability, and are not specific to the grid environment. The correlation coefficient of results obtained on a standalone machine versus the grid environment is found to be better than 0.933 for spectra and 0.984 for protein identification, demonstrating the validity of our approach. Finally, we examine the effect of different splitting schemes of spectra and protein data on CPU time and overall wall clock time, revealing that judicious splitting of both data sets yields best overall performance.

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Type
conference paper
Author(s)
Zosso, Dominique  
Podvinec, Michael
Müller, Markus
Aebersold, Ruedi
Peitsch, Manuel C.
Schwede, Torsten
Date Issued

2007

Publisher

IOS Press

Publisher place

Netherlands

Published in
From Genes to Personalized HealthCare: Grid Solutions for the Life Sciences - Proceedings of HealthGrid 2007
Series title/Series vol.

Studies in HealthTechnology and Informatics

Volume

126

Start page

3

End page

12

Subjects

Proteomics

•

Tandem Mass Spectrometry

•

MS/MS

•

Protein Identification

•

PC Grid

URL

URL

http://geneva2007.healthgrid.org/
Editorial or Peer reviewed

REVIEWED

Written at

OTHER

EPFL units
LTS  
Event nameEvent placeEvent date
5th HealthGrid Conference

Geneva, Switzerland

22.-26.4.2007

Available on Infoscience
March 7, 2007
Use this identifier to reference this record
https://infoscience.epfl.ch/handle/20.500.14299/3592
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