Great, thanks David - your suggestion worked.

Matt, FYI when I open the Myrimatch pepXML output in notepad and search for
'<sample_enzyme' I get no result so it seems like this tag is missing for me
also. I'm using MyriMatch 1.6.75 (2010-7-14).

Thanks,
Ben

On Wed, Aug 11, 2010 at 5:35 PM, David Shteynberg <
[email protected]> wrote:

> Apologies for any rushed conclusions, but we came across this bug at
> the isb just yesterday.  I will have to verify the exact version of MM
> that failed to generate this tag at isb.  BTW RefreshParser was fixed
> to generate a reasonable error in this scenario instead of a seg
> fault.
>
> David
>
>
>
> On 8/11/10, Matthew Chambers <[email protected]> wrote:
> >   Er, in what version of MM have you seen this bug? I don't remember that
> > bug, and that code hasn't been changed since at least March 2009.
> > Latest version gives:
> > <sample_enzyme name="trypsin">
> > <specificity cut="KRM" no_cut="" sense="C" />
> > </sample_enzyme>
> > This search was configured to allow cleavage after protein N-terminal
> > methionines, which unfortunately pepXML cannot represent properly.
> >
> > -Matt
> >
> >
> > On 8/11/2010 10:35 AM, David Shteynberg wrote:
> >> Hi Ben,
> >>
> >> The latest version of myrimatch leaves out the sample enzyme flag that
> >> RefreshParser relies on.  Simply add these two lines to the top of
> >> your myrimatch pep.xml files to get them to process:
> >>
> >> <sample_enzyme name="trypsin">
> >> </sample_enzyme>
> >>
> >>
> >> This a temporary solution that will allow RefreshParser to process
> >> Myrimatch results for now, until Myrimatch fixes its pepXML output.
> >>
> >>
> >> Cheers,
> >> -David
> >>
> >> On Wed, Aug 11, 2010 at 6:30 AM, Ben Collins<[email protected]>
>  wrote:
> >>> Hi,
> >>>
> >>> I'm trying to get TPP to work with Myrimatch pepXML output. Everything
> >>> seems to be going okay but I get an error at the RefreshParser stage
> >>> (see output below). The only slightly unusual thing I did was to
> >>> change '.pepXML' extensions that Myrimatch produces to the TPP
> >>> convention '.pep.xml'. I'm using the windows release version (4.3.1)
> >>> on Windows Vista Business 64 bit (this configuration normally works
> >>> fine with TPP).
> >>>
> >>> Many thanks for any suggestions,
> >>> Ben
> >>>
> >>>
> >>> # Commands for session DUQCFMUJJ on Wed Aug 11 13:41:25 2010
> >>> # BEGIN COMMAND BLOCK
> >>> ###### BEGIN Command Execution ######
> >>> [Wed Aug 11 13:41:25 2010] EXECUTING: run_in c:/Inetpub/wwwroot/ISB/
> >>> data/ben_data/100721_MCF7_SCX; c:\Inetpub\tpp-bin\xinteract  -
> >>> Nmyri_test_interact.pep.xml -p0.05 -l7 -OA -ddecoy_ c:/Inetpub/wwwroot/
> >>> ISB/data/ben_data/100721_MCF7_SCX/100721_MCF7_SCX-r002.myri.pep.xml c:/
> >>> Inetpub/wwwroot/ISB/data/ben_data/100721_MCF7_SCX/100721_MCF7_SCX-
> >>> r003.myri.pep.xml c:/Inetpub/wwwroot/ISB/data/ben_data/100721_MCF7_SCX/
> >>> 100721_MCF7_SCX-r004.myri.pep.xml
> >>> OUTPUT:
> >>>
> >>> c:\Inetpub\tpp-bin\xinteract (TPP v4.3 JETSTREAM rev 1, Build
> >>> 200909091257 (MinGW))
> >>>
> >>> running: "C:/Inetpub/tpp-bin/InteractParser
> >>> "myri_test_interact.pep.xml" "c:/Inetpub/wwwroot/ISB/data/ben_data/
> >>> 100721_MCF7_SCX/100721_MCF7_SCX-r002.myri.pep.xml" "c:/Inetpub/wwwroot/
> >>> ISB/data/ben_data/100721_MCF7_SCX/100721_MCF7_SCX-r003.myri.pep.xml"
> >>> "c:/Inetpub/wwwroot/ISB/data/ben_data/100721_MCF7_SCX/100721_MCF7_SCX-
> >>> r004.myri.pep.xml" -L"7""
> >>>   file 1: c:/Inetpub/wwwroot/ISB/data/ben_data/100721_MCF7_SCX/
> >>> 100721_MCF7_SCX-r002.myri.pep.xml
> >>>   file 2: c:/Inetpub/wwwroot/ISB/data/ben_data/100721_MCF7_SCX/
> >>> 100721_MCF7_SCX-r003.myri.pep.xml
> >>>   file 3: c:/Inetpub/wwwroot/ISB/data/ben_data/100721_MCF7_SCX/
> >>> 100721_MCF7_SCX-r004.myri.pep.xml
> >>>   processed altogether 41870 results
> >>>
> >>>
> >>>   results written to file c:/Inetpub/wwwroot/ISB/data/ben_data/
> >>> 100721_MCF7_SCX/myri_test_interact.pep.xml
> >>>
> >>>   direct your browser to
> >>>
> http://localhost/ISB/data/ben_data/100721_MCF7_SCX/myri_test_interact.pep.shtml
> >>>
> >>>
> >>>
> >>> command completed in 231 sec
> >>>
> >>> running: "C:/Inetpub/tpp-bin/PeptideProphetParser
> >>> "myri_test_interact.pep.xml" MINPROB=0.05 ACCMASS DECOY=decoy_"
> >>> using Accurate Mass Bins
> >>> Using Decoy Label "decoy_".
> >>>   (MyriMatch)
> >>> WARNING!! The discriminant function for Myrimatch is not yet
> >>> complete.  It is presented here to help facilitate trial and
> >>> discussion.  Reliance on this code for publishable scientific results
> >>> is not recommended.
> >>> WARNING: Myrimatch only support semi-parametric PeptideProphet
> >>> modelling, which relies on a DECOY search.
> >>> adding Accurate Mass mixture distr
> >>> WARNING: Myrimatch only support semi-parametric PeptideProphet
> >>> modelling, which relies on a DECOY search.
> >>> WARNING: Myrimatch only support semi-parametric PeptideProphet
> >>> modelling, which relies on a DECOY search.
> >>> WARNING: Myrimatch only support semi-parametric PeptideProphet
> >>> modelling, which relies on a DECOY search.
> >>> WARNING: Myrimatch only support semi-parametric PeptideProphet
> >>> modelling, which relies on a DECOY search.
> >>> WARNING: Myrimatch only support semi-parametric PeptideProphet
> >>> modelling, which relies on a DECOY search.
> >>> WARNING: Myrimatch only support semi-parametric PeptideProphet
> >>> modelling, which relies on a DECOY search.
> >>> init with MyriMatch
> >>> MS Instrument info: Manufacturer: UNKNOWN, Model: UNKNOWN, Ionization:
> >>> UNKNOWN, Analyzer: UNKNOWN, Detector: UNKNOWN
> >>>
> >>>   PeptideProphet  (TPP v4.3 JETSTREAM rev 1, Build 200909091257
> >>> (MinGW)) akel...@isb
> >>>   read in 399 1+, 19065 2+, 17201 3+, 758 4+, 56 5+, 5 6+, and 4 7+
> >>> spectra.
> >>> Initialising statistical models ...
> >>> Iterations: .........10.........20.........30
> >>> WARNING: Mixture model quality test failed for charge (1+).
> >>> WARNING: Mixture model quality test failed for charge (5+).
> >>> WARNING: Mixture model quality test failed for charge (6+).
> >>> WARNING: Mixture model quality test failed for charge (7+).
> >>> model complete after 31 iterations
> >>> command completed in 315 sec
> >>>
> >>> running: "C:/Inetpub/tpp-bin/ProphetModels.pl -i
> >>> myri_test_interact.pep.xml"
> >>> Analyzing myri_test_interact.pep.xml ...
> >>> Reading Accurate Mass Model model +1 ...
> >>> Reading Accurate Mass Model model +2 ...
> >>> Reading Accurate Mass Model model +3 ...
> >>> Reading Accurate Mass Model model +4 ...
> >>> Reading Accurate Mass Model model +5 ...
> >>> Reading Accurate Mass Model model +6 ...
> >>> Reading Accurate Mass Model model +7 ...
> >>> Parsing search results "100721_MCF7_SCX-r002 (MyriMatch)"...
> >>>   =>  Total of 313 hits.
> >>> Parsing search results "100721_MCF7_SCX-r003 (MyriMatch)"...
> >>>   =>  Total of 4614 hits.
> >>> Parsing search results "100721_MCF7_SCX-r004 (MyriMatch)"...
> >>>   =>  Total of 4303 hits.
> >>> command completed in 11 sec
> >>>
> >>> running: "C:/Inetpub/tpp-bin/DatabaseParser
> >>> "myri_test_interact.pep.xml""
> >>> command completed in 3 sec
> >>>
> >>> running: "C:/Inetpub/tpp-bin/RefreshParser
> >>> "myri_test_interact.pep.xml" "C:\Inetpub\wwwroot\ISB\data\dbase
> >>> \uniprot_human_CP_canonical_isoform_cRAP_decoy_2010_08.fasta""
> >>>
> >>> command "C:/Inetpub/tpp-bin/RefreshParser "myri_test_interact.pep.xml"
> >>> "C:\Inetpub\wwwroot\ISB\data\dbase
> >>> \uniprot_human_CP_canonical_isoform_cRAP_decoy_2010_08.fasta"" failed:
> >>> Unknown error
> >>>
> >>> command "C:/Inetpub/tpp-bin/RefreshParser "myri_test_interact.pep.xml"
> >>> "C:\Inetpub\wwwroot\ISB\data\dbase
> >>> \uniprot_human_CP_canonical_isoform_cRAP_decoy_2010_08.fasta"" exited
> >>> with non-zero exit code: 255
> >>> QUIT - the job is incomplete
> >>>
> >>> command "c:\Inetpub\tpp-bin\xinteract -Nmyri_test_interact.pep.xml -
> >>> p0.05 -l7 -OA -ddecoy_ c:/Inetpub/wwwroot/ISB/data/ben_data/
> >>> 100721_MCF7_SCX/100721_MCF7_SCX-r002.myri.pep.xml c:/Inetpub/wwwroot/
> >>> ISB/data/ben_data/100721_MCF7_SCX/100721_MCF7_SCX-r003.myri.pep.xml c:/
> >>> Inetpub/wwwroot/ISB/data/ben_data/100721_MCF7_SCX/100721_MCF7_SCX-
> >>> r004.myri.pep.xml" failed: Unknown error
> >>> END OUTPUT
> >>> RETURN CODE:65280
> >>> ###### End Command Execution ######
> >>> # All finished at Wed Aug 11 13:51:14 2010
> >>> # END COMMAND BLOCK
> >>>
> >>> --
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