view mzml_id_getter.py @ 0:2810c956ec39 draft

planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/recetox_aplcms commit 506df2aef355b3791567283e1a175914f06b405a
author recetox
date Mon, 13 Feb 2023 10:26:41 +0000
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#!/usr/bin/env python

import argparse
import sys

from pymzml.run import Reader


def main(argv):
    parser = argparse.ArgumentParser(description='Get run ID from an mzML file.')
    parser.add_argument('mzml_file', help='Path to an mzML file to get run ID from.')
    args = parser.parse_args()

    mzml = Reader(args.mzml_file)
    id = mzml.info['run_id']

    if id is not None:
        with open("sample_name.txt", mode='x') as f:
            f.write(id)


if __name__ == '__main__':
    main(sys.argv[1:])