From: Brian P. <bri...@in...> - 2013-05-29 18:35:00
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I've improved the documentation for that (in the usage statement, and the online docs): MS2Denoise [<peaks_in_window> [<window_width_Da> [multicharge_fragment_relaxation]]] Noise peak removal for spectra with precursor ions. <peaks_in_window> - the number peaks to select in window, default is 6. <window_width_Da> - the width of the window in Da, default is 30. <multicharge_fragment_relaxation> - if "true" (the default), allows more data below multiply charged precursors. The filter first removes any m/z values above the precursor mass minus the mass of glycine. It then removes any m/z values within .5 Da of the unfragmented precursor mass. Finally it retains only the<peaks_in_window> most intense ions within a sliding window of<window_width_Da> Da. If<multicharge_fragment_relaxation> is true, allows more peaks at lower mass (i.e. below precursor). If<window_width_Da> is set to 0, the window size defaults to the highest observed mass in the spectrum (this leaving only<peaks_in_window> ions in the output spectrum). Reference: "When less can yield more - Computational preprocessing of MS/MS spectra for peptide identification", Bernhard Y. Renard, Marc Kirchner, Flavio Monigatti, Alexander R. Ivanov, Juri Rappsilber, Dominic Winter, Judith A. J. Steen, Fred A. Hamprecht and Hanno Steen Proteomics, 9, 4978-4984, 2009. On Wed, May 29, 2013 at 9:32 AM, Witold E Wolski <wew...@gm...> wrote: > Hi, > > I am trying to use MS2Denoise to smooth data? At least this is my first > guess that this filter is doing this. > > I am running it on an mzML file containing profile spectra at ms 2 level. > > > msconvert --filter "MS2Denoise 2000 20" --mzML -z --outfile smooth.mzML > prep.mzML > > This is the command I am using. > > the only difference between input and output is: > > < <spectrum index="0" id="scan=1" defaultArrayLength="4420" > dataProcessingRef="dp_sp_0"> > --- > > <spectrum index="0" id="scan=1" defaultArrayLength="4420" > dataProcessingRef="pwiz_Reader_conversion"> > 127c132 > < <spectrum index="1" id="scan=2" defaultArrayLength="4367"> > --- > > <spectrum index="1" id="scan=2" defaultArrayLength="4367" > dataProcessingRef="pwiz_Reader_conversion"> > 173c178 > < <spectrum index="2" id="scan=3" defaultArrayLength="4303"> > --- > > I am using msvoncert: > > ProteoWizard release: 3.0.4585 (2013-5-24) > ProteoWizard MSData: 3.0.4585 (2013-5-24) > ProteoWizard Analysis: 3.0.4584 (2013-5-24) > Build date: May 29 2013 18:00:05 > > > > Help highly appreciated. > > Witold > > > > > ------------------------------------------------------------------------------ > Introducing AppDynamics Lite, a free troubleshooting tool for Java/.NET > Get 100% visibility into your production application - at no cost. > Code-level diagnostics for performance bottlenecks with <2% overhead > Download for free and get started troubleshooting in minutes. > http://p.sf.net/sfu/appdyn_d2d_ap1 > _______________________________________________ > proteowizard-support mailing list > pro...@li... > https://lists.sourceforge.net/lists/listinfo/proteowizard-support > > |