Hi David

It's me again.

Thanks for giving me new PeptideProphet file to run MS_GF+ results.

But it still has problem to execute new test file. 

Would you please tell me the reason?


Thanks a lot.

Honglan Li


XML file: 
https://drive.google.com/file/d/0B5i2NDdAgrJ3bDY4ZFR0M2VOUlU/view?usp=sharing

Recieved msg:

----
KDModel.cpp, Line 144
Expression: idx < posprobs_ -> size()

This application has requested the Runtime to terminate it in an unusual 
way.
Please contact the application's support team for more information
----

Thanks a lot.

Honglan Li


2016년 3월 30일 수요일 오후 8시 30분 5초 UTC+9, Honglan Li 님의 말:
>
>
> Hi David.
>
> It's me again.
>
> Last time, you gave me the s/w and cmd. 
>
> It's works well when I use the sample I gave you, and some other XML files.
>
> But for some XML files, it still do not work well.
>
>                   XML file: 
> https://drive.google.com/file/d/0B5i2NDdAgrJ3bDY4ZFR0M2VOUlU/view?usp=sharing
>
>
> When I executed this test sample (test2.pep.xml.xml) with the cmd you told 
> me
>
>                 "PeptideProphetParser.exe test2.pep.xml.xml NONPARAM 
> DECOY=XXX DECOYPROBS MINPROB=0 CLEVEL=2 ACCMASS PPM"
>
> I received msg as follows: (detail: I added captured error msg file)
>
> ----
> KDModel.cpp, Line 144
> Expression: idx < posprobs_ -> size()
>
> This application has requested the Runtime to terminate it in an unusual 
> way.
> Please contact the application's support team for more information
> ----
>
> Would you please tell me what happened to this XML file?
>
> Thanks a lot.
>
> Honglan Li
>
>
>
> 2016년 3월 28일 월요일 오전 8시 52분 13초 UTC+9, Honglan Li 님의 말:
>>
>> Thank you very much for your help, David.
>>
>> It works well now.
>>
>> Best wishes,
>> Honglan Li
>>
>>
>> 2016년 3월 26일 토요일 오전 2시 33분 59초 UTC+9, David Shteynberg 님의 말:
>>>
>>> Hello Honglan,
>>>
>>> I was unable to replicate the error on my system, however, I have tested 
>>> that this command works on a more recently compiled version of 
>>> PeptideProphet.  You can download the binary here 
>>> https://dl.dropboxusercontent.com/u/21286225/PeptideProphetParser.exe 
>>> and run as follows
>>>
>>> PeptideProphetParser.exe test.pep.xml NONPARAM DECOY=XXX DECOYPROBS 
>>> MINPROB=0 CLEVEL=2 ACCMASS PPM
>>>
>>>
>>> I had to set a fairly high CLEVEL value on this data since MSGF+ suffers 
>>> from scoring highly of some decoys and is not always accurate at the 
>>> critical 1% error.  The WARNING message in the new code has been updated to 
>>> reflect this problem.
>>>
>>> Cheers,
>>> -David
>>>
>>>
>>> On Thu, Mar 24, 2016 at 8:21 PM, Honglan Li <[email protected]> wrote:
>>>
>>>> Thanks for your quick reply. 
>>>>>
>>>>
>>>>    I tried the command you told me, but it stll didn't work well.
>>>>    
>>>>    The warning msg is "*The discriminant function for MSGFPL is not 
>>>> yet complete" *
>>>>
>>>>    How to fix it ?
>>>>
>>>>    
>>>>   *cmd*: 
>>>>
>>>>   xinteract -OPd -p0 -dXXX_ *.xml
>>>>
>>>>
>>>>
>>>>  *Error msg I received*
>>>>
>>>>   ----
>>>> running: "/usr/local/tpp/bin/DatabaseParser 'interact.pep.xml'"
>>>> command completed in 0 sec 
>>>>
>>>> running: "/usr/local/tpp/bin/RefreshParser 'interact.pep.xml' 
>>>> 'C:\Users\JONGHUN\Desktop\MSGFPlus\C-25fmol\C-25fmol-R1\1. 
>>>> CYH\uniprot_C+H+Y+48.revCat.fasta'"
>>>>   - Building Commentz-Walter keyword tree...  - Searching the 
>>>> tree...opening "C:\Users\JONGHUN\Desktop\MSGFPlus\C-25fmol\C-25fmol-R1\1. 
>>>> CYH\uniprot_C+H+Y+48.revCat.fasta" as 
>>>> "/home/mllab/hllee/uniprot_C+H+Y+48.revCat.fasta"
>>>>
>>>>   - Linking duplicate entries...  - Printing results...
>>>>
>>>> command completed in 11 sec 
>>>>
>>>> running: "/usr/local/tpp/bin/PeptideProphetParser 'interact.pep.xml' 
>>>> NONPARAM DECOYPROBS MINPROB=0 DECOY=XXX_"
>>>> Using Decoy Label "XXX_".
>>>> Decoy Probabilities will be reported.
>>>> Using non-parametric distributions
>>>>  (MS-GF+) (minprob 0)
>>>> WARNING!! *The discriminant function for MSGFPL 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.
>>>> init with MS-GF+ trypsin 
>>>> Segmentation fault (core dumped)
>>>>
>>>> command "/usr/local/tpp/bin/PeptideProphetParser 'interact.pep.xml' 
>>>> NONPARAM DECOYPROBS MINPROB=0 DECOY=XXX_" exited with non-zero exit code: 
>>>> 35584
>>>> QUIT - the job is incomplete
>>>>
>>>> -----
>>>>
>>>> *XML format per PSM: (file: *
>>>> https://drive.google.com/file/d/0B5i2NDdAgrJ3Y2diWDAzVHBQSm8/view?usp=sharing
>>>> )
>>>>
>>>>   <spectrum_query 
>>>> spectrum="C:\Users\JONGHUN\Desktop\MSGFPlus\C-25fmol\C-25fmol-R1\1. 
>>>> CYH\C-25fmol-R1_QEx2_000090.51174.51174.4" spectrumNativeID="index=51174" 
>>>> start_scan="51174" end_scan="51174" 
>>>> precursor_neutral_mass="3972.990669523105" assumed_charge="4" index="1">
>>>>       <search_result>
>>>>         <search_hit hit_rank="1" 
>>>> peptide="VGNVGEDDAIPEVSHAGDVSTTLQVVNELLKDETVAPR" peptide_prev_aa="R" 
>>>> peptide_next_aa="F" protein="sp|P16521|EF3A_YEAST" num_tot_proteins="1" 
>>>> calc_neutral_pep_mass="3972.99140194498" massdiff="7.32421875e-04" 
>>>> protein_descr="sp|P16521|EF3A_YEAST Elongation factor 3A OS=Saccharomyces 
>>>> cerevisiae (strain ATCC 204508 / S288c) GN=YEF3 PE=1 SV=4" 
>>>> num_tol_term="2" 
>>>> num_missed_cleavages="1">
>>>>           <search_score name="raw" value="269"/>
>>>>           <search_score name="denovo" value="289"/>
>>>>           <search_score name="SpecEValue" 
>>>> value="2.8337685502588284E-39"/>
>>>>           <search_score name="EValue" value="1.2856572993111488E-31"/>
>>>>           <search_score name="IsotopeError" value="0"/>
>>>>         </search_hit>
>>>>       </search_result>
>>>>     </spectrum_query>
>>>>
>>>>
>>>>
>>>>
>>>>
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>>>
>>>

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