Comments (1)
In review here: https://code.emsl.pnl.gov/mass-spectrometry/corems/-/merge_requests/86
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Related Issues (20)
- Add lipid workflow as a test to corems
- Develop database interface base class for flexible database linking
- Develop MetabRef-specific database interface
- Apply properties to ChromaPeak attributes HOT 1
- Add private attributes and associated properties to LCMSMassFeatures class to lcms_dev on CoreMS HOT 3
- Add functionality for parameter import/export using a tmol file HOT 1
- Modify peak picking parameters to call by relative abundance (not absolute value) HOT 1
- Remove api token path parameter and usage from LCMSBase object HOT 1
- Remove `to_json` method from `LCMSParameters` in `encapsulation/factory/parameters` module to `encapsulation/output/parameter_to_json` and adjust usage throughout. HOT 1
- Add lipidomics-specific exporter to lcms_dev on CoreMS
- Format lcms_dev branch according to PEP8 guidelines
- Re-render documentation on lcms_dev branch on CoreMS
- Merge lcms_dev into main branch of CoreMS
- Modify metadata generation scripts for GC-MS Metabolomics workflow to berkeley-schema-fy24 HOT 2
- Generate updated metadata and upload HOT 1
- Load Configuration and Calibration objects for berkeley-schema implementation HOT 1
- Add DatabaseInterface module and classes for pulling and organizing spectra from MetabRef HOT 1
- Upgrade wdl to version 1.0 HOT 1
- Add CI/CD to test wdl validity HOT 1
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