Re: [spctools-discuss] Re: AB-Sciex TripleTOF wiff files to MGFs

2011-03-03 Thread Brian Pratt
A well constructed mzXML file would normally be somewhat smaller than its mzML equivalent - make sure you've got peaklist compression turned on (IIRC the msconvert default is no compression, which seems like a Bad Thing to me but there you have it). On Wed, Mar 2, 2011 at 10:37 PM, ben

[spctools-discuss] Re: AB-Sciex TripleTOF wiff files to MGFs

2011-03-03 Thread ben
I haven't played around with compression, but that would be simply adding a -z [ --zlib ] correct? I am using this page more so than the help on sourceforge for command arguments. http://groups.google.com/group/xcms/msg/53e2a2b462a5448c Thanks for the help, and I will let you know if something

Re: [spctools-discuss] Re: AB-Sciex TripleTOF wiff files to MGFs

2011-03-03 Thread Matthew Chambers
If you want to post some samples to the list, use msconvert with an index filter. Try: msconvert original.mzML -o subset --filter index 0-100 -z msconvert original.mzML -o subset --filter index 0-100 -z --mzXML And attach both the subset mzML and mzXML for comparison. Thanks, -Matt On

[spctools-discuss] Re: AB-Sciex TripleTOF wiff files to MGFs

2011-03-02 Thread ben
I wanted to provide an update. First, it appears that the export mgf function from within peak view isn't very good and talking to AB folks it seems more like a left over beta function. Second, the AB folks have unanimously confirmed that the mascot.dlll script shouldn't be used in this case

[spctools-discuss] Re: AB-Sciex TripleTOF wiff files to MGFs

2011-02-22 Thread lgillet
Hi Ben, I do not know how you look at your runs, but the PeakView software (I use Version 1.1) that open the raw data wiff files can actually export mgf format. You need to open the IDA runs with the IDA explorer, select filtering criteria you want (rt, spectra quality) and then right click on the

[spctools-discuss] Re: AB-Sciex TripleTOF wiff files to MGFs

2011-02-22 Thread ben
I didn't realize that about PeakView. So I am generating mgfs from a single wiff 4 ways right now: dll script within Analyst, dll script within Daemon, through PeakView (which took about two seconds), and using Distiller (going on 3 hours right now). Then I will compare them. Thanks for all the