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Diann update #182

Merged
merged 30 commits into from
May 17, 2022
Merged

Diann update #182

merged 30 commits into from
May 17, 2022

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ypriverol
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PR checklist

  • This comment contains a description of changes (with reason).
  • If you've fixed a bug or added code that should be tested, add tests!
    • If you've added a new tool - have you followed the pipeline conventions in the contribution docs
    • If necessary, also make a PR on the nf-core/quantms branch on the nf-core/test-datasets repository.
  • Make sure your code lints (nf-core lint).
  • Ensure the test suite passes (nextflow run . -profile test,docker --outdir <OUTDIR>).
  • Usage Documentation in docs/usage.md is updated.
  • Output Documentation in docs/output.md is updated.
  • CHANGELOG.md is updated.
  • README.md is updated (including new tool citations and authors/contributors).

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github-actions bot commented May 17, 2022

nf-core lint overall result: Passed ✅

Posted for pipeline commit a212019

+| ✅ 146 tests passed       |+
#| ❔   3 tests were ignored |#

❔ Tests ignored:

✅ Tests passed:

Run details

  • nf-core/tools version 2.4.1
  • Run at 2022-05-17 18:06:25

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@jpfeuffer jpfeuffer left a comment

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Also, changelog missing. And documentation updates.

Comment on lines +251 to +255
require(MSstats)
# BUG groupComparisonPlots function: re-run OpenMStoMSstatsTMTFormat
quant <- OpenMStoMSstatsTMTFormat(data, useUniquePeptide=useUniquePeptide, rmPSM_withfewMea_withinRun=rmPSM_withfewMea_withinRun,
rmProtein_with1Feature=rmProtein_with1Feature
)
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What is this? quant is never used after that. And why is MSstats loaded?

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If MSstats is needed for those plots, it needs to go into the dependencies!

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@daichengxin can you take care of this comment. Please do your changes in the diann branch.

@@ -246,5 +241,28 @@ if (l == 1) {
test.MSstatsTMT <- groupComparisonTMT(contrast.matrix=contrast_mat, data=processed.quant)
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If you do parse_contrasts, the TODO can go

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@daichengxin can you take care of this comment. Please do your changes in the diann branch.

modules/local/assemble_empirical_library/meta.yml Outdated Show resolved Hide resolved
modules/local/assemble_empirical_library/meta.yml Outdated Show resolved Hide resolved
modules/local/diann_preliminary_analysis/meta.yml Outdated Show resolved Hide resolved
modules/local/diannsummary/meta.yml Outdated Show resolved Hide resolved
modules/local/diannsummary/meta.yml Outdated Show resolved Hide resolved
description: FASTA sequence databases
pattern: "*.{fasta,fa}"
- cfg:
description: Silico-predicted spectral library by deep leaning predictor in DIA-NN
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Isn't this using the empirical library?? Not the initially predicted one

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@ypriverol
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LFQ is failing @daichengxin

@jpfeuffer
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Weird, seems to work now. Conda hiccups are normal though.

@ypriverol
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@jpfeuffer Can I merge now and convert your comments into issue ;)

@jpfeuffer
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jpfeuffer commented May 17, 2022

Yes:

  • MSstats TMT weird code and import of MSstats, plus remove TODOs
  • Changelog and docu
  • double check usage of empirical vs insilico library in module descriptions

@ypriverol ypriverol mentioned this pull request May 17, 2022
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@ypriverol
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#183 issue created by @jpfeuffer

@ypriverol ypriverol merged commit a30389f into dev May 17, 2022
@ypriverol ypriverol deleted the diann branch November 3, 2023 09:25
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3 participants