Great!  Thank you.

On Wed, Apr 6, 2022, 7:04 AM Shagun Gupta <[email protected]> wrote:

> Hi David
>
> Apologies, for some reason my post that it all worked out never made it
> through. Instead one of my older replies I think got posted again. Sorry
> for the confusion and thank you for your help!
>
> Shagun
>
> On Tuesday, April 5, 2022 at 3:09:59 PM UTC-4 David Shteynberg wrote:
>
>> Hello Shagun,
>>
>> Thank you for sharing your complete dataset.  I still found the following
>> in the conditions file you included:
>> TMT10_VB297695_condition.xml
>>
>>   <massTolerance value="0.2" />
>>
>>
>> This should be set to 0.001 for this analysis to work on your type of
>> label.  I am attaching the condition file with this change included so you
>> can rerun Libra using the condition file attached.  Please make sure the
>> tolerance is correct in the file when you try running Libra again and if
>> you still see a problem please provide your TPP results interact* files
>> etc...
>>
>> Cheers,
>> -David
>>
>>
>>
>> On Fri, Apr 1, 2022 at 10:03 PM Shagun Gupta <[email protected]> wrote:
>>
>>> The zip folder for the files can be found here:
>>> https://drive.google.com/drive/folders/1hnR2igUXM_K-Pld2xspikeu_xnLGUdMc?usp=sharing
>>>
>>> Let me know if you have any issues.
>>>
>>> Best
>>> Shagun
>>>
>>> On Friday, March 25, 2022 at 1:34:57 PM UTC-4 David Shteynberg wrote:
>>>
>>>> Please place your files on a shared drive and send me a link.
>>>>
>>>> On Fri, Mar 25, 2022 at 10:34 AM Shagun Gupta <[email protected]>
>>>> wrote:
>>>>
>>>>> Hi David
>>>>>
>>>>> Could you suggest a good email to reach you with? I can share the
>>>>> pep.xml's and Libra condition file that way?
>>>>>
>>>>> -Shagun
>>>>>
>>>>> On Friday, March 25, 2022 at 11:00:38 AM UTC-4 David Shteynberg wrote:
>>>>>
>>>>>> Hello Shagun,
>>>>>>
>>>>>> Thank you for your email and interest in the TPP.  I have recently
>>>>>> been comparing TMTPro analysis by ProteomeDiscoverer and Byonic to that
>>>>>> produced by TPP's Libra.  As far as I can tell, when I run and compare 
>>>>>> the
>>>>>> quantities (intensities) they are mostly the same between Libra (without
>>>>>> isotopic impurity correction and 0 pseudocounts) and the
>>>>>> ProteomeDiscoverer/Byonic.  Execution of Libra is defined in the
>>>>>> conditions.xml file that has to be defined for each Libra run.  I would 
>>>>>> be
>>>>>> happy to take a look at your data and analysis to see if it can be placed
>>>>>> on the right path for the Libra analysis to work.  Please post your 
>>>>>> results
>>>>>> somewhere I can download and test.
>>>>>>
>>>>>> Cheers,
>>>>>> -David
>>>>>>
>>>>>> On Fri, Mar 25, 2022 at 6:36 AM Shagun Gupta <[email protected]>
>>>>>> wrote:
>>>>>>
>>>>>>> Hello
>>>>>>>
>>>>>>> Our lab has been trying to use Libra to quantify MS2 (Ion-trap)
>>>>>>> identification and MS3-based quantification of TMT datasets and we were
>>>>>>> trying to benchmark with an artificial yeast and mammalian spiked 
>>>>>>> dataset
>>>>>>> with known fold-change (FC) values. However we observe drastically
>>>>>>> different values than expected, something we don't observe with other
>>>>>>> search engines for the same dataset.
>>>>>>>
>>>>>>> Has this issue been encountered before/ is there something obviously
>>>>>>> wrong when running with TPP that might cause this? Happy to provide 
>>>>>>> further
>>>>>>> details on the dataset and parameters used to run with (most of them
>>>>>>> default apart from additions like static modification for TMT and
>>>>>>> specification of MS3 for quantification among others).
>>>>>>>
>>>>>>> Thank you,
>>>>>>> Shagun
>>>>>>>
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>>>>>>>
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>>>>> .
>>>>>
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>>>
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