Hello Shagun,

Also please include your mzML files, which contain the actual data that
Libra quantifies.

Thanks!
-David

On Fri, Mar 25, 2022 at 10:34 AM David Shteynberg <
[email protected]> 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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