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Comments (18)

KaiLiCn avatar KaiLiCn commented on June 18, 2024

Sorry, I can't see you picture. Could you share it again?

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perhag972 avatar perhag972 commented on June 18, 2024

Picture1

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KaiLiCn avatar KaiLiCn commented on June 18, 2024

Hi there,

Here is a bug to export batch spectra. I will fix it in next version.

I noticed you only need one spectra. Could you please try this way to export it? Click the Export in the toolbar.
image

Please let me know if it doesn't works.

Kai

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KaiLiCn avatar KaiLiCn commented on June 18, 2024

By the way, you can open PDV directly inside FragPipe right now. It will provide more information than standalone version.
image

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perhag972 avatar perhag972 commented on June 18, 2024

Hi,

It worked when i exported a single spectrum according to your instructions, but i actually wanted to export the whole batch so it would be really great if you could fix the bug. And thanks for the tip about Fragpipe, will try it out.

BR Per

I actually wanted to export the whole batch

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KaiLiCn avatar KaiLiCn commented on June 18, 2024

OK. I will try to fix it this week. Will let you you after updating the release.

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perhag972 avatar perhag972 commented on June 18, 2024

Great, thanks, Btw, i have noticed that it can take very long time to load big datasets. Any tips on how to speed this up?

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KaiLiCn avatar KaiLiCn commented on June 18, 2024

I optimized some steps in FragPipe version, but I don't have time to update the codes here. Could you try if it helps? And the batch export function in FragPipe is locked. I will test and open it soon.

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perhag972 avatar perhag972 commented on June 18, 2024

OK, I will try.

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KaiLiCn avatar KaiLiCn commented on June 18, 2024

Hi,

I just updated the package. Could you try it?
https://www.dropbox.com/s/d0qmm08luix0gcv/FP-PDV-1.0.3.jar?dl=0

Enter FragPipe folder and replace FP-PDV-1.0.3.jar with this new one:
image

There is a button to export selected spectra:
image

This function is still under testing. Please let me know if you have any issues. Or you can open a new issue under FragPipe respositry.

Kai

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perhag972 avatar perhag972 commented on June 18, 2024

It takes VERY long time to load big datasets into PDV (for example psm.tsv from fragpipe). Any tips on how this can be speeded up?

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KaiLiCn avatar KaiLiCn commented on June 18, 2024

As I showed in the previous post, you could try to open PDV inside FragPipe using the new package I shared with you. You don't need to import psm.tsv by yourself. After searching, click the button.
image
https://www.dropbox.com/s/d0qmm08luix0gcv/FP-PDV-1.0.3.jar?dl=0
It will increase 5-10X speed. Let me know if you have difficulty running it.

Kai

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perhag972 avatar perhag972 commented on June 18, 2024

I have tested also to use PDV inside Fragpipe with the file you sent to me. It works for small datasets but it still takes very long time to open big datasets.

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KaiLiCn avatar KaiLiCn commented on June 18, 2024

What's the raw file type? And how many raw files do you have?

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anesvi avatar anesvi commented on June 18, 2024

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KaiLiCn avatar KaiLiCn commented on June 18, 2024

Thanks, @anesvi! After changing mgf to mzml in the next version, we could open it much faster. I am testing that part. @perhag972 sorry for the inconvenience. I will send you a pre-release version once I finish testing.

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perhag972 avatar perhag972 commented on June 18, 2024

It is 42 rawfiles from timstof data converted to mgf file of ca 5 GB each processed in fragpipe

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KaiLiCn avatar KaiLiCn commented on June 18, 2024

I see. Will let you know if I have any updates.

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