Mercurial > repos > recetox > msmetaenhancer
comparison msmetaenhancer_wrapper.py @ 3:f387ebd6b734 draft
"planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/msmetaenhancer commit 6858f7bc3c3cf68fd5002a2241c79923b2ca9acd"
author | recetox |
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date | Fri, 06 May 2022 12:21:30 +0000 |
parents | 8338640d8676 |
children | 2ada1099f42e |
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2:8338640d8676 | 3:f387ebd6b734 |
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10 parser = argparse.ArgumentParser(description="Annotate MSP file.") | 10 parser = argparse.ArgumentParser(description="Annotate MSP file.") |
11 parser.add_argument("--input_file", type=str, help="Path to query spectra file in MSP format.") | 11 parser.add_argument("--input_file", type=str, help="Path to query spectra file in MSP format.") |
12 parser.add_argument("--output_file", type=str, help="Path to output spectra file.") | 12 parser.add_argument("--output_file", type=str, help="Path to output spectra file.") |
13 parser.add_argument("--jobs", type=str, help="Sequence of conversion jobs to be used.") | 13 parser.add_argument("--jobs", type=str, help="Sequence of conversion jobs to be used.") |
14 parser.add_argument("--log_file", type=str, help="Path to log with details of the annotation process.") | 14 parser.add_argument("--log_file", type=str, help="Path to log with details of the annotation process.") |
15 parser.add_argument("--log_level", type=str, default='info', | |
16 help="Severity of log messages present in the log file.") | |
15 args = parser.parse_args() | 17 args = parser.parse_args() |
16 | 18 |
17 app = Application(log_file=args.log_file) | 19 app = Application(log_level=args.log_level, log_file=args.log_file) |
18 | 20 |
19 # set matchms logging level to avoid extensive messages in stdout while reading file | 21 # set matchms logging level to avoid extensive messages in stdout while reading file |
20 set_matchms_logger_level("ERROR") | 22 set_matchms_logger_level("ERROR") |
21 # import .msp file | 23 # import .msp file |
22 app.load_spectra(args.input_file, file_format='msp') | 24 app.load_spectra(args.input_file, file_format='msp') |