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Merge pull request #398 from ypriverol/dev
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Migration from python in house scripts to quantms-utils
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ypriverol authored Aug 14, 2024
2 parents 70bdb1e + be1fb69 commit e557d27
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2 changes: 2 additions & 0 deletions .github/workflows/ci.yml
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Expand Up @@ -48,6 +48,8 @@ jobs:
exec_profile: singularity
- test_profile: test_lfq
exec_profile: conda
- test_profile: test_dda_id
exec_profile: conda
steps:
- name: Check out pipeline code
uses: actions/checkout@v4
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11 changes: 11 additions & 0 deletions CHANGELOG.md
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Expand Up @@ -8,19 +8,30 @@ and this project adheres to [Semantic Versioning](https://semver.org/spec/v2.0.0
### `Added`

- [#386](https://github.com/bigbio/quantms/pull/386) Make validation of ontology terms optional
- [#398](https://github.com/bigbio/quantms/pull/398) Python scripts moved to quantms-utils package
- [#389](https://github.com/bigbio/quantms/pull/389) Introduction to DIANN 1.9.1 to the pipeline, only available in Singularity.
- [#397](https://github.com/bigbio/quantms/pull/397) More options included in SDRF validation.

### Fixed

- [#400](https://github.com/bigbio/quantms/pull/400) The random file selection when using `random_preanalysis` with DIANN is now reproducible.

### `Changed`

- [#391](https://github.com/bigbio/quantms/pull/391) Move mzML statistics to parquet files from csv
- [#386](https://github.com/bigbio/quantms/pull/386) Make optional the validation of ontology terms in the input SDRF file.
- [#374](https://github.com/bigbio/quantms/pull/374) Create the common msgf+ database in one step before the msgf+ runs on each ms run file.
-

### `Fixed`

- [#396](https://github.com/bigbio/quantms/pull/396) Added verification of tar archive unpacking to prevent silent failures.

### `Dependencies`

- quantms-utils==0.0.7
- diann==1.9.1

### `Parameters`

- `validate_ontologies`: enable or disable validating ontologies in the input SDRF file.
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39 changes: 0 additions & 39 deletions bin/add_sage_feature.py

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223 changes: 0 additions & 223 deletions bin/check_samplesheet.py

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