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MS Amanda, a Universal Identification Algorithm Optimized for High Accuracy Tandem Mass Spectra
Author(s) -
Viktoria Dorfer,
Peter Pichler,
Thomas Stranzl,
Johannes Stadlmann,
Thomas Taus,
Stephan Winkler,
Karl Mechtler
Publication year - 2014
Publication title -
journal of proteome research
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 1.644
H-Index - 161
eISSN - 1535-3907
pISSN - 1535-3893
DOI - 10.1021/pr500202e
Subject(s) - mascot , mass spectrometry , tandem mass spectrometry , mass spectrum , proteome , computer science , fragmentation (computing) , shotgun proteomics , algorithm , identification (biology) , database search engine , tandem mass tag , chemistry , search engine , proteomics , chromatography , information retrieval , quantitative proteomics , biology , botany , biochemistry , political science , law , gene , operating system
Today's highly accurate spectra provided by modern tandem mass spectrometers offer considerable advantages for the analysis of proteomic samples of increased complexity. Among other factors, the quantity of reliably identified peptides is considerably influenced by the peptide identification algorithm. While most widely used search engines were developed when high-resolution mass spectrometry data were not readily available for fragment ion masses, we have designed a scoring algorithm particularly suitable for high mass accuracy. Our algorithm, MS Amanda, is generally applicable to HCD, ETD, and CID fragmentation type data. The algorithm confidently explains more spectra at the same false discovery rate than Mascot or SEQUEST on examined high mass accuracy data sets, with excellent overlap and identical peptide sequence identification for most spectra also explained by Mascot or SEQUEST. MS Amanda, available at http://ms.imp.ac.at/?goto=msamanda , is provided free of charge both as standalone version for integration into custom workflows and as a plugin for the Proteome Discoverer platform.

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