Re: [Mzmine-devel] Centroided data error and other queries

2015-01-07 Thread Tomas Pluskal
Hi Peter, > I am analysing thermo .raw files using Mzmine and I keep getting an error > message which says “1 or more data files contain centroided data at MS1 > level, the mass detection may produce unexpected results”. This occurred when > using the wavelet transform algorithm for mass detect

[Mzmine-devel] Centroided data error and other queries

2015-01-07 Thread Peter Harrison
Hi everyone, I am new to Mzmine, so apologies for any repeated queries or beginners mistakes! I am analysing thermo .raw files using Mzmine and I keep getting an error message which says "1 or more data files contain centroided data at MS1 level, the mass detection may produce unexpected result

Re: [Mzmine-devel] Centroided data error

2014-12-29 Thread Tomas Pluskal
Hi Anthony, Do you see this problem with any data file or only some of them? Are all the files 100% in profile mode? Can you send an example raw file? Tomas On Dec 29, 2014, at 12:23 AM, Anthony Carrasquillo mailto:acarr...@mit.edu>> wrote: Hi Everyone, I am analyzing thermo .raw files with

[Mzmine-devel] Centroided data error

2014-12-29 Thread Anthony Carrasquillo
Hi Everyone, I am analyzing thermo .raw files with mz mine and am getting an error message that “the data file contains centroided data at ms1and the mass detection may produce unexpected results”. I had tried running with exact mass in the mass detection operation. I am running the developm