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Move batch script to helper scripts
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@@ -93,11 +93,11 @@ def batch_lcms_metabolomics():
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overall_start = time.time()
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# Parameters
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input_directory = "/Users/heal742/LOCAL/staging_test"
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output_directory = "/Users/heal742/LOCAL/staging_processed/processed_EMP500_b2_test"
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corems_toml_path = "/Users/heal742/LOCAL/05_NMDC/02_MetaMS/data_processing/_emp_500_lcms_metabolomics/metadata/emp_lcms_metab_corems_params.toml"
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input_directory = "/Users/heal742/LOCAL/staging"
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output_directory = "/Users/heal742/LOCAL/staging_processed/processed_ecofab"
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corems_toml_path = "/Users/heal742/LOCAL/05_NMDC/02_MetaMS/data_processing/_bioscales_lcms_metabolomics/metadata/bioscales_hilic_corems.toml"
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msp_file_path = "/Users/heal742/LOCAL/05_NMDC/02_MetaMS/metams/test_data/test_lcms_metab_data/20250407_database.msp"
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scan_translator_path = "/Users/heal742/LOCAL/05_NMDC/02_MetaMS/data_processing/_emp_500_lcms_metabolomics/metadata/emp500_scan_translator.toml"
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scan_translator_path = "/Users/heal742/LOCAL/05_NMDC/02_MetaMS/data_processing/_bioscales_lcms_metabolomics/metadata/bioscales_scan_translator.toml"
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cores = 5
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print("=" * 80)

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