Re: [spctools-discuss] ProteinProphet sticking in findDegenGroups3

2020-10-22 Thread Emily Kawaler
While those tests are still running, I pulled out all 185 of the proteins that are in the 10OV pepXMLs but not in 01-09OV, figuring that maybe one of those is causing the error. I've uploaded that to the same folder everything else is in (it's called 10OV_uniq.fasta) - I don't see anything

Re: [spctools-discuss] ProteinProphet sticking in findDegenGroups3

2020-10-22 Thread 'David Shteynberg' via spctools-discuss
Hi Emily, I analyzed the search results that you sent and I am seeing some strange things in at least one of the files you gave me. This may be causing some of the problems you saw. In file 03CPTAC_OVprospective_W_PNNL_20161212_B1S3_f13.pepXML on line 171821 there are some strange characters

Re: [spctools-discuss] ProteinProphet sticking in findDegenGroups3

2020-10-22 Thread Emily Kawaler
Hello, Thanks so much for taking a look! I think the selenocysteines ("U") are likely not the problem, since I've got those in all of my databases, including the ones that run correctly. I'm looking at 03CPTAC_OVprospective_W_PNNL_20161212_B1S3_f13.pepXML and I don't see anything odd in line

Re: [spctools-discuss] ProteinProphet sticking in findDegenGroups3

2020-10-22 Thread Emily Kawaler
Hello, Thanks so much for taking a look! I think the selenocysteines ("U") are likely not the problem, since I've got those in all of my databases, including the ones that run correctly. I'm looking at 03CPTAC_OVprospective_W_PNNL_20161212_B1S3_f13.pepXML and I don't see anything odd in line

Re: [spctools-discuss] DIA to mzML question

2020-10-22 Thread Mark Athanason
If you follow the link further https://skyline.ms/wiki/home/software/Skyline/page.view?name=OverlappingWindowScheme&_docid=wiki%3A41195689-d578-1036-894e-e465a393d561 they explain how to actually make the isolation scheme in skyline that is compatible with several MS manufacturers; I believe the

[spctools-discuss] DIA to mzML question

2020-10-22 Thread jane n
Hi all, I have acquired a bunch of files on my Eclipse to build a DIA library using an 8mz window in overlap mode (ie essentially 4mz windows) and I'm not clear if the Convert to MzML is demultiplexing to 4mz windows? I've tried doing it manually in MSconvert but the conversion fails. On the

Re: [spctools-discuss] DIA to mzML question

2020-10-22 Thread 'David Shteynberg' via spctools-discuss
Dear Jane, I cannot help you with the demultiplexing, because I have not used that feature before in MSConvert. But if you do manage to get a regular DIA mzML file out of the conversion you can use the DISCo tool available in the TPP under Tools->DIA->Extract MS2 Fragments that will generate a

Re: [spctools-discuss] DIA to mzML question

2020-10-22 Thread Science Gurl
Hey David! Yes, I'd like to know more about DISCo. I was poking around that tool too and kinda got lost :) That's what 3 years away from proteomics will do for you! The MSconvert within TPP creates mzML files fine, I guess I don't know how to check to see if they have been demultiplexed. Can

Re: [spctools-discuss] DIA to mzML question

2020-10-22 Thread Mark Athanason
Jane, See this from the Skyline team: https://skyline.ms/wiki/home/software/Skyline/page.view?name=DemultiplexingOverlappingDIAWindows Best Mark On Thu, Oct 22, 2020 at 4:28 PM Science Gurl wrote: > Hey David! > > Yes, I'd like to know more about DISCo. I was poking around that tool too >

Re: [spctools-discuss] DIA to mzML question

2020-10-22 Thread Science Gurl
Hi Mark, Thanks for the suggestion... This is what I've been doing but I get an error. I'll switch this query to the SkyLine team for some more troubleshooting! -jane On Thu, 22 Oct 2020 at 17:04, Mark Athanason wrote: > Jane, > > See this from the Skyline team: > >

Re: [spctools-discuss] ProteinProphet sticking in findDegenGroups3

2020-10-22 Thread 'David Shteynberg' via spctools-discuss
I just re extracted that file and I don't see the issue anymore. Perhaps this was a decompression issue. Thanks for checking. -David On Thu, Oct 22, 2020 at 12:19 PM Emily Kawaler wrote: > Hello, > Thanks so much for taking a look! I think the selenocysteines ("U") are > likely not the

Re: [spctools-discuss] DIA to mzML question

2020-10-22 Thread Science Gurl
Thanks! On Thu, 22 Oct 2020 at 17:11, Mark Athanason wrote: > If you follow the link further > > https://skyline.ms/wiki/home/software/Skyline/page.view?name=OverlappingWindowScheme&_docid=wiki%3A41195689-d578-1036-894e-e465a393d561 > > they explain how to actually make the isolation scheme in