Nesvilab / FragPipe

A cross-platform proteomics data analysis suite
http://fragpipe.nesvilab.org
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Fragpipe v22.0 error with DIA-PASEF file #1606

Closed hcadre closed 2 months ago

hcadre commented 3 months ago

Dear All,

Thank you very much first and foremost for your continuing work on this marvelous piece of software!

I took the chance to test drive the new FragPipe version v22.0 with a single phospho-enriched sample measured by DIA-PASEF using diaTracer for spectrum deconvolution and and DIA-NN for quantification. During the quantification step, however, Fragpipe stops and throws an error message:

image

Can you see any obvious mistake that I made? Log file attached.

Thank you for looking into that issue!

log_2024-06-03_11-20-31.txt

fcyu commented 3 months ago

Could you verify if Python and EasyPQP have been well configured in the "config" tab of FragPipe?

Thanks,

Fengchao

hcadre commented 3 months ago

Hi Fengchao,

Thank you very much for getting back to me so rapidly!

To me it appears that both components are properly installed and configured:

Best,

Hannes

On 6/3/2024 7:05 PM, Fengchao wrote:

Could you verify if Python and EasyPQP have been well configured in the "config" tab of FragPipe?

Thanks,

Fengchao

— Reply to this email directly, view it on GitHub https://github.com/Nesvilab/FragPipe/issues/1606#issuecomment-2145715924, or unsubscribe https://github.com/notifications/unsubscribe-auth/AD4XSS4C2BYRAXKI6QZIIULZFSO55AVCNFSM6AAAAABIW4YZ52VHI2DSMVQWIX3LMV43OSLTON2WKQ3PNVWWK3TUHMZDCNBVG4YTKOJSGQ. You are receiving this because you authored the thread.Message ID: @.***>

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Hi Fengchao,

Thank you very much for getting back to me so rapidly!

To me it appears that both components are properly installed and configured:


Best,

Hannes


On 6/3/2024 7:05 PM, Fengchao wrote:

Could you verify if Python and EasyPQP have been well configured in the "config" tab of FragPipe?

Thanks,

Fengchao


Reply to this email directly, view it on GitHub, or unsubscribe.
You are receiving this because you authored the thread.Message ID: <Nesvilab/FragPipe/issues/1606/2145715924@github.com>

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fcyu commented 3 months ago

Hi Hannes,

Then, could you double check if the "Spec Lib" tab was enabled/checked?

Thanks,

Fengchao

hcadre commented 3 months ago

Hi Fengchao, "Spec Lib" tab was checked / enabled. image I guess it is not essential to also tick "Generate spectral library from search results" Best, Hannes

fcyu commented 3 months ago

Hi Hannes,

Is the problem resolved after you enabled the spec lib generation?

Thanks,

Fengchao

hcadre commented 3 months ago

Hi Fengchao,

Back in the lab I performed another test run with a DIA-PASEF file. Spec lib generation was enabled, however, this time SpecLibGen stopped with the error message: "module pandas has not attribute DataFrame" (see below). The corresponding log file is attached.

Best,

Hannes

On 6/10/2024 2:54 PM, Fengchao wrote:

Hi Hannes,

Is the problem resolved after you enabled the spec lib generation?

Thanks,

Fengchao

— Reply to this email directly, view it on GitHub https://github.com/Nesvilab/FragPipe/issues/1606#issuecomment-2158271032, or unsubscribe https://github.com/notifications/unsubscribe-auth/AD4XSS6GUBRYRLDHUSTEQ43ZGWOYRAVCNFSM6AAAAABIW4YZ52VHI2DSMVQWIX3LMV43OSLTON2WKQ3PNVWWK3TUHMZDCNJYGI3TCMBTGI. You are receiving this because you authored the thread.Message ID: @.***>

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--------------bMkbzSiBpQ0nrWDGIdbSh5ED Content-Type: text/html; charset="UTF-8" Content-Transfer-Encoding: 8bit

<!DOCTYPE html>

Hi Fengchao,

Back in the lab I performed another test run with a DIA-PASEF file. Spec lib generation was enabled, however, this time SpecLibGen stopped with the error message: "module pandas has not attribute DataFrame" (see below). The corresponding log file is attached.

Best,

Hannes


On 6/10/2024 2:54 PM, Fengchao wrote:

Hi Hannes,

Is the problem resolved after you enabled the spec lib generation?

Thanks,

Fengchao


Reply to this email directly, view it on GitHub, or unsubscribe.
You are receiving this because you authored the thread.Message ID: <Nesvilab/FragPipe/issues/1606/2158271032@github.com>

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fcyu commented 3 months ago

Hi Hannes,

Can you go to https://github.com/Nesvilab/FragPipe/issues/1606 and upload your log file there?

Thanks.

Fengchao

hcadre commented 3 months ago

Done! log_2024-06-17_15-50-48.txt Hannes

fcyu commented 3 months ago

I think it is because the Pandas package is too old. Could run the following command to upgrade it

pip uninstall pandas
pip install pandas>=1.5.0

Best,

Fengchao

hcadre commented 3 months ago

Re-installed Pandas package. Now version 2.2.2 is available:

image

Still the same error, no matter whether DIA_Speclib_Quant_diaPASEF or DIA_Speclib_Quant_Phospho_diaPASEF workflow is loaded:

image

log file is attached:

log_2024-06-19_14-23-40.txt

Best,

Hannes

fcyu commented 3 months ago

Thanks for the testing. I will let @guoci take a look. Maybe pandas version 2.2.2 is too new?

Thanks,

Fengchao

fcyu commented 3 months ago

@guoci , any idea about this one?

Thanks,

Fengchao

guoci commented 3 months ago

@hcadre I think you might have installed on to a different python. Can you show the full output of pip show pandas? There should be a Location: field after the License: field, like this:

$ pip show pandas
Name: pandas
Version: 2.0.3
Summary: Powerful data structures for data analysis, time series, and statistics
Home-page: 
Author: 
Author-email: The Pandas Development Team <pandas-dev@python.org>
License: BSD 3-Clause License

Copyright (c) 2008-2011, AQR Capital Management, LLC, Lambda Foundry, Inc. and PyData Development Team
All rights reserved.

Copyright (c) 2011-2023, Open source contributors.

Redistribution and use in source and binary forms, with or without
modification, are permitted provided that the following conditions are met:

* Redistributions of source code must retain the above copyright notice, this
  list of conditions and the following disclaimer.

* Redistributions in binary form must reproduce the above copyright notice,
  this list of conditions and the following disclaimer in the documentation
  and/or other materials provided with the distribution.

* Neither the name of the copyright holder nor the names of its
  contributors may be used to endorse or promote products derived from
  this software without specific prior written permission.

THIS SOFTWARE IS PROVIDED BY THE COPYRIGHT HOLDERS AND CONTRIBUTORS "AS IS"
AND ANY EXPRESS OR IMPLIED WARRANTIES, INCLUDING, BUT NOT LIMITED TO, THE
IMPLIED WARRANTIES OF MERCHANTABILITY AND FITNESS FOR A PARTICULAR PURPOSE ARE
DISCLAIMED. IN NO EVENT SHALL THE COPYRIGHT HOLDER OR CONTRIBUTORS BE LIABLE
FOR ANY DIRECT, INDIRECT, INCIDENTAL, SPECIAL, EXEMPLARY, OR CONSEQUENTIAL
DAMAGES (INCLUDING, BUT NOT LIMITED TO, PROCUREMENT OF SUBSTITUTE GOODS OR
SERVICES; LOSS OF USE, DATA, OR PROFITS; OR BUSINESS INTERRUPTION) HOWEVER
CAUSED AND ON ANY THEORY OF LIABILITY, WHETHER IN CONTRACT, STRICT LIABILITY,
OR TORT (INCLUDING NEGLIGENCE OR OTHERWISE) ARISING IN ANY WAY OUT OF THE USE
OF THIS SOFTWARE, EVEN IF ADVISED OF THE POSSIBILITY OF SUCH DAMAGE.

Location: /home/ci/anaconda3/lib/python3.11/site-packages
Requires: numpy, numpy, python-dateutil, pytz, tzdata
Required-by: altair, bokeh, datasets, datashader, holoviews, hvplot, panel, seaborn, statsmodels, streamlit, xarray

That location should start with: D:\MSFragger\Anaconda\

fcyu commented 2 months ago

No response.