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Modify GCMS wdl workflow parameters and remove extra parameter from g…
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…cms function
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kheal committed Dec 16, 2024
1 parent 64ce234 commit 10aaa96
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Showing 2 changed files with 9 additions and 10 deletions.
1 change: 0 additions & 1 deletion metaMS/gcmsWorkflow.py
Original file line number Diff line number Diff line change
Expand Up @@ -69,7 +69,6 @@ def worker(args):

def run_gcms_metabolomics_workflow_wdl(
file_paths,
calibration_reference_path,
calibration_file_path,
output_directory,
output_filename,
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18 changes: 9 additions & 9 deletions wdl/metams_input_gcms.json
Original file line number Diff line number Diff line change
@@ -1,14 +1,14 @@
{
"gcmsMetabolomics.runMetaMS.file_paths": [
"gcmsMetabolomics.runMetaMSGCMS.file_paths": [
"./data/raw_data/GCMS_FAMES_01_GCMS-01_20191023.cdf",
"./data/raw_data/GCMS_FAMES_01_GCMS-01_20191023.cdf"
],
"gcmsMetabolomics.runMetaMS.calibration_file_path": "./data/raw_data/GCMS_FAMES_01_GCMS-01_20191023.cdf",
"gcmsMetabolomics.runMetaMS.output_directory": "test_output",
"gcmsMetabolomics.runMetaMS.output_filename": "test_dataset",
"gcmsMetabolomics.runMetaMS.output_type": "csv",
"gcmsMetabolomics.runMetaMS.corems_toml_path": "./configuration/gcms_corems.toml",
"gcmsMetabolomics.runMetaMS.nmdc_metadata_path": "./configuration/nmdc_metadata.json",
"gcmsMetabolomics.runMetaMS.metabref_token_path": "./configuration/metabref.token",
"gcmsMetabolomics.runMetaMS.jobs_count": 4
"gcmsMetabolomics.runMetaMSGCMS.calibration_file_path": "./data/raw_data/GCMS_FAMES_01_GCMS-01_20191023.cdf",
"gcmsMetabolomics.runMetaMSGCMS.output_directory": "test_output",
"gcmsMetabolomics.runMetaMSGCMS.output_filename": "test_dataset",
"gcmsMetabolomics.runMetaMSGCMS.output_type": "csv",
"gcmsMetabolomics.runMetaMSGCMS.corems_toml_path": "./configuration/gcms_corems.toml",
"gcmsMetabolomics.runMetaMSGCMS.nmdc_metadata_path": "./configuration/nmdc_metadata.json",
"gcmsMetabolomics.runMetaMSGCMS.metabref_token_path": "./configuration/metabref.token",
"gcmsMetabolomics.runMetaMSGCMS.jobs_count": 4
}

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