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472a063
Big refactoring for all modules to subfolders
ypriverol May 21, 2025
f701378
Merge branch 'dev' of https://github.com/bigbio/quantms into dev
ypriverol May 21, 2025
98b2bdd
Big refactoring for all modules to subfolders
ypriverol May 21, 2025
8344c2c
standardization of names in meta.yml for all tools.
ypriverol May 21, 2025
2693ebb
Fixing references between processes.
ypriverol May 21, 2025
dd9fa1e
change in other names to follow standard.
ypriverol May 21, 2025
87ba131
change in other names to follow standard.
ypriverol May 21, 2025
ddeb16e
change in other names to follow standard.
ypriverol May 21, 2025
ae031cd
change in other names to follow standard.
ypriverol May 21, 2025
dc8c10a
more changes in subworkflows to be consistent
ypriverol May 21, 2025
4b25861
update modules path
ypriverol May 21, 2025
8474c2f
change search engines from search_engine_{name} to {name}
ypriverol May 21, 2025
ee198fd
change search engines from search_engine_{name} to {name}
ypriverol May 21, 2025
123a9e9
change search engines from search_engine_{name} to {name}
ypriverol May 21, 2025
f5abec0
change search engines from search_engine_{name} to {name}
ypriverol May 21, 2025
2adb3ed
change search engines from search_engine_{name} to {name}
ypriverol May 21, 2025
b354cba
change search engines from search_engine_{name} to {name}
ypriverol May 21, 2025
92ec2d5
change search engines from search_engine_{name} to {name}
ypriverol May 21, 2025
e8ee7d9
change search engines from search_engine_{name} to {name}
ypriverol May 22, 2025
7514b27
change search engines from search_engine_{name} to {name}
ypriverol May 22, 2025
1f2d250
change search engines from search_engine_{name} to {name}
ypriverol May 22, 2025
098c248
change search engines from search_engine_{name} to {name}
ypriverol May 22, 2025
85c734d
change search engines from search_engine_{name} to {name}
ypriverol May 22, 2025
ec5b2ca
change search engines from search_engine_{name} to {name}
ypriverol May 22, 2025
6b6ef6c
change search engines from search_engine_{name} to {name}
ypriverol May 22, 2025
5f4ef85
change search engines from search_engine_{name} to {name}
ypriverol May 22, 2025
cf57a2b
change search engines from search_engine_{name} to {name}
ypriverol May 22, 2025
202432d
change search engines from search_engine_{name} to {name}
ypriverol May 22, 2025
33fa262
change DIANN modules and subworkflows
ypriverol May 22, 2025
b9d31c1
remove module not in used.
ypriverol May 22, 2025
bde0e35
remove module not in used.
ypriverol May 22, 2025
23d1531
remove module not in used.
ypriverol May 22, 2025
49ba725
remove module not in used.
ypriverol May 22, 2025
af08b0e
Standardization of names in meta.yml for all tools & Big refactoring …
ypriverol May 21, 2025
24a2b06
Merge remote-tracking branch 'origin/dev' into dev
ypriverol May 22, 2025
facb6aa
SUMMARY_PIPELINE subworkflow added
ypriverol May 22, 2025
0b03778
SUMMARY_PIPELINE subworkflow added
ypriverol May 22, 2025
ef4f3a5
SUMMARY_PIPELINE subworkflow added
ypriverol May 22, 2025
4d19300
SUMMARY_PIPELINE subworkflow added
ypriverol May 22, 2025
9b80a54
general name change to process name
ypriverol May 24, 2025
0bb8ae6
remove extract_psm_features from modules.config
ypriverol May 24, 2025
1e33165
remove extract_psm_features from modules.config
ypriverol May 24, 2025
658d557
remove extract_psm_features from modules.config
ypriverol May 24, 2025
0e70d8a
remove extract_psm_features from modules.config
ypriverol May 24, 2025
e3b1a71
continue update modules.config
ypriverol May 24, 2025
92554d1
continue update modules.config
ypriverol May 24, 2025
08fb44c
summary_pipeline -> pmultiqc
ypriverol May 24, 2025
36457b5
summary_pipeline -> pmultiqc
ypriverol May 24, 2025
ef8bbcb
summary_pipeline -> pmultiqc
ypriverol May 24, 2025
c7d4df5
summary_pipeline -> pmultiqc
ypriverol May 24, 2025
97a0584
summary_pipeline -> pmultiqc
ypriverol May 24, 2025
4923b34
both msstats -> msstats folder
ypriverol May 24, 2025
b3bf57a
both msstats -> msstats folder
ypriverol May 24, 2025
915cd43
both msstats -> msstats folder
ypriverol May 24, 2025
de703dd
both msstats -> msstats folder
ypriverol May 24, 2025
a25ef7b
both msstats -> msstats folder
ypriverol May 24, 2025
403dfcc
define a dummy path for all exports
ypriverol May 24, 2025
3eb8eb1
define a dummy path for all exports
ypriverol May 24, 2025
36a1582
define the output for id workflow
ypriverol May 25, 2025
9bea230
changes in the names in meta.yml
ypriverol May 25, 2025
faecac4
if features enable then, export mzml_statistics
ypriverol May 25, 2025
0adc37f
restructure of configs in conf/
ypriverol May 25, 2025
5808948
restructure of configs in conf/
ypriverol May 25, 2025
5ba2d56
restructure of configs in conf/
ypriverol May 25, 2025
f0eba27
restructure of configs in conf/
ypriverol May 25, 2025
c8305ff
1.4.1 -> 1.5.0 because major version
ypriverol May 25, 2025
f0538a7
first iteration of verbose_modules.config
ypriverol May 25, 2025
c833bd6
first iteration of verbose_modules.config
ypriverol May 25, 2025
4f16130
first iteration of verbose_modules.config
ypriverol May 25, 2025
bf92003
first iteration of verbose_modules.config
ypriverol May 25, 2025
524421f
additional modules added to verbose_modules.config
ypriverol May 25, 2025
aedcf7b
additional modules added to verbose_modules.config
ypriverol May 25, 2025
fe20dcd
additional modules added to verbose_modules.config
ypriverol May 26, 2025
cb8dafb
protein_identification -> peptide_postprocessing
ypriverol May 26, 2025
a76b2e2
Update conf/modules/modules.config
ypriverol May 26, 2025
16bdc54
Documentation of outputs updated.
ypriverol May 27, 2025
e16fd88
Merge remote-tracking branch 'origin/dev' into dev
ypriverol May 27, 2025
0727e82
Documentation of outputs updated.
ypriverol May 27, 2025
beda47d
Update docs/output.md
ypriverol May 27, 2025
a929a7c
Update docs/output.md
ypriverol May 27, 2025
0b00e37
Update docs/output.md
ypriverol May 27, 2025
e68381c
Documentation of outputs updated.
ypriverol May 27, 2025
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Original file line number Diff line number Diff line change
@@ -1,4 +1,4 @@
process ASSEMBLE_EMPIRICAL_LIBRARY {
process DIANN_ASSEMBLE_EMPIRICAL_LIBRARY {
tag "$meta.experiment_id"
label 'process_low'
label 'diann'
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Original file line number Diff line number Diff line change
@@ -1,4 +1,4 @@
process DIANNCONVERT {
process DIANN_CONVERT {
tag "$meta.experiment_id"
label 'process_medium'

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Original file line number Diff line number Diff line change
@@ -1,4 +1,4 @@
name: DIANNCONVERT
name: diannconvert
description: A module to convert DIA report files to MSstats, Triqler and mzTab
keywords:
- DIA-NN
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Original file line number Diff line number Diff line change
@@ -1,4 +1,4 @@
process GENERATE_DIANN_CFG {
process DIANN_GENERATE_CFG {
tag "$meta.experiment_id"
label 'process_tiny'

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Original file line number Diff line number Diff line change
@@ -1,4 +1,4 @@
process SILICOLIBRARYGENERATION {
process DIANN_INSILICO_LIBRARY_GENERATION {
tag "$fasta.Name"
label 'process_medium'
label 'diann'
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Original file line number Diff line number Diff line change
@@ -1,4 +1,4 @@
process DIANNSUMMARY {
process DIANN_SUMMARY {
tag "$meta.experiment_id"
label 'process_high'
label 'diann'
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Original file line number Diff line number Diff line change
@@ -1,4 +1,4 @@
process MSSTATS {
process MSSTATS_LFQ {
tag "$msstats_csv_input.Name"
label 'process_medium'

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Original file line number Diff line number Diff line change
@@ -1,4 +1,4 @@
name: MSSTATS
name: MSSTATS_LFQ
description: A module to performance proteomics statistical analysis using MSstats tool.
keywords:
- MSstats
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Original file line number Diff line number Diff line change
@@ -1,4 +1,4 @@
process MSSTATSTMT {
process MSSTATS_TMT {
tag "$msstatstmt_csv_input.Name"
label 'process_medium'

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Original file line number Diff line number Diff line change
@@ -1,4 +1,4 @@
name: MSSTATSTMT
name: MSSTATS_TMT
description: |
A module to performance proteomics statistical analysis with tandem mass tag (TMT) labeling using MSstatsTMT tool.
- MSstatsTMT
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File renamed without changes.
File renamed without changes.
File renamed without changes.
16 changes: 8 additions & 8 deletions workflows/dia.nf
Original file line number Diff line number Diff line change
Expand Up @@ -7,14 +7,14 @@
//
// MODULES: Local to the pipeline
//
include { GENERATE_DIANN_CFG as DIANNCFG } from '../modules/local/generate_diann_cfg/main'
include { DIANNCONVERT } from '../modules/local/diannconvert/main'
include { MSSTATS } from '../modules/local/msstats/main'
include { DIANN_PRELIMINARY_ANALYSIS } from '../modules/local/diann_preliminary_analysis/main'
include { ASSEMBLE_EMPIRICAL_LIBRARY } from '../modules/local/assemble_empirical_library/main'
include { SILICOLIBRARYGENERATION } from '../modules/local/silicolibrarygeneration/main'
include { INDIVIDUAL_FINAL_ANALYSIS } from '../modules/local/individual_final_analysis/main'
include { DIANNSUMMARY } from '../modules/local/diannsummary/main'
include { DIANN_GENERATE_CFG as DIANNCFG } from '../modules/local/diann/generate_cfg/main'
include { DIANN_CONVERT as DIANNCONVERT } from '../modules/local/diann/convert/main'
include { MSSTATS_LFQ as MSSTATS } from '../modules/local/msstats/msstats_lfq/main'
include { DIANN_PRELIMINARY_ANALYSIS } from '../modules/local/diann/preliminary_analysis/main'
include { DIANN_ASSEMBLE_EMPIRICAL_LIBRARY as ASSEMBLE_EMPIRICAL_LIBRARY } from '../modules/local/diann/assemble_empirical_library/main'
include { DIANN_INSILICO_LIBRARY_GENERATION as SILICOLIBRARYGENERATION } from '../modules/local/diann/insilico_library_generation/main'
include { INDIVIDUAL_FINAL_ANALYSIS } from '../modules/local/diann/individual_final_analysis/main'
include { DIANN_SUMMARY as DIANNSUMMARY } from '../modules/local/diann/summary/main'

//
// SUBWORKFLOWS: Consisting of a mix of local and nf-core/modules
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2 changes: 1 addition & 1 deletion workflows/lfq.nf
Original file line number Diff line number Diff line change
Expand Up @@ -8,7 +8,7 @@
// MODULES: Local to the pipeline
//
include { PROTEOMICSLFQ } from '../modules/local/openms/proteomicslfq/main'
include { MSSTATS } from '../modules/local/msstats/main'
include { MSSTATS_LFQ as MSSTATS } from '../modules/local/msstats/msstats_lfq/main'

//
// SUBWORKFLOWS: Consisting of a mix of local and nf-core/modules
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2 changes: 1 addition & 1 deletion workflows/tmt.nf
Original file line number Diff line number Diff line change
Expand Up @@ -8,7 +8,7 @@
// MODULES: Local to the pipeline
//
include { FILEMERGE } from '../modules/local/openms/filemerge/main'
include { MSSTATSTMT } from '../modules/local/msstatstmt/main'
include { MSSTATS_TMT as MSSTATSTMT } from '../modules/local/msstats/msstats_tmt/main'

//
// SUBWORKFLOWS: Consisting of a mix of local and nf-core/modules
Expand Down
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