[spctools-discuss] How to make X!Tandem disregards charge state in mzXML file

2012-04-27 Thread polia...@med.umich.edu
Hi, I am analyzing some old data from Velos that was acquired with charge state screening during acquisition, i.e. charge state is determined and stored in .raw file. However, we now want to search this data without pre-determined charge state since it is often not accurately assigned (this is

Re: [spctools-discuss] How to make X!Tandem disregards charge state in mzXML file

2012-04-27 Thread Matthew Chambers
The chargeStatePredictor filter in msconvert can override existing charge states and put in multiple possible charge states for multiply charged spectra and charge=1 for singly charged spectra (based on %TIC below the precursor m/z). It works fine with mzML but I'm not sure how X!T would handle

Re: [spctools-discuss] How to make X!Tandem disregards charge state in mzXML file

2012-04-27 Thread Jimmy Eng
Try re-generating the index at the end of the mzXML file after you edit out the charge state. The TPP tools are failing to parse your mzXML because the scan index is no longer valid. You can re-generate the index using indexmzXML which is distributed with the TPP