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Messages - majah

31
XCMS Online / mzdiff setting
Hello,

I would like to set mzdiff to -0.005. However, the filed seems to only accept 5 characters, so if I want the value to be negative, the smallest number I can put in is -0.01.

Is there a way to increase the filed so that it fits -0.005?

Thanks much!

Majda
32
XCMS Online / Peak Exclusion
Hi,

Is there a way to exclude a particular peak before processing data in Web XCMS?

Thank you very much!

Sincerely,
Majda
33
XCMS Online / Error
Hello,

I tried processing two datasets previously used with different parameters (and the extraction worked that first time). However, this second time around, there is an error saying "XCMS Processing Failed".
The only thing I changed in the parameter settings is no retention time.

Job ID is: 1998

Thank you very much!

Majda
35
XCMS Online / Re: Prefilter Parameters
Ops, just noticed you wrote:

prefilter peaks=k
prefilter peaks=l

The second is supposed to be prefilter intensity, correct?

Thanks!

Majda
36
XCMS Online / Re: File Check Error
Hi, Ralf,

Thanks for checking into this. I am sorry I deleted the dataset before you could reproduce the error. I noticed some files didn't upload correctly, for whatever reason, so I re-uploaded one of the datasets.

However, I am still having problems with the graph of TICs (original), and you can see this under job ID 1952.

Thanks very much for the time you take to answer my questions!

Majda
38
XCMS Online / Prefilter Parameters
Hello,

I am following parameters optimized for our LC/MS datasets, and in R, this parameter is

prefilter=c(1,30)

In the web-based version of XCMS, would this be prefilter intensity and prefilter peaks?

Thanks very much!

Majda
39
XCMS Online / File Check Error
Hi,

I am trying to rerun some analysis with different parameters. I have uploaded these datasets before and they went through the file check just fine. This time I am getting an error and the process is stuck at the "file check" point. Job ID is 1898.

Also, is it possible to get more space on the web-based XCMS page?

Thank you very much!

Majda
40
XCMS Online / Total Ion Chromatograms
Hello,

1. There is a problem I don't know how to fix, and this has happened to me a few times now. I ran some data on XCMS online, and Total Ion Chromatograms (original) does not show any peaks, while the corrected graph looks fine.

The ID of the job I ran is 1799.

Can you please help me fix this?

2. Additionally, I am still unable to change any parameters on UPLC/MS without having an error message pop up saying that min peak width has to be less than the max peak width, and so I cannot save the changes.

I appreciate your help very, very much!

Sincerely,
Majda
41
XCMS Online / Retention Time Correction
Hi,

I am trying to run  my data without a retention time correction so that I can compare data before and after the correction. However, whenever I run the data, an error message appears half way into the run.

1) Am I supposed to be setting up some specific parameters not related to the retention time parameters, i.e. feature detection "method" or "integration method" under feature detection? Are these parameters supposed to be something specific for LC/MS data?

2) Also, I would like to be able to change min peak width and max peak width to 5 and 12, specifically, as I am trying to reproduce some data and follow someone else's foot steps for this particular analysis.

Thank you very much! I appreciate your responses! I am new to XCMS but I am very excited about it, and looking forward to using it more and more!

Sincerely,
Majda