Mercurial > repos > recetox > matchms_formatter
comparison matchms_networking_wrapper.py @ 13:3dad3f53402f draft
planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/matchms commit 13f4f7af12ec694a5f4ab7b3e52f46a4f67a245e
| author | recetox |
|---|---|
| date | Sun, 19 Nov 2023 14:36:56 +0000 |
| parents | 1b09315a3f87 |
| children |
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| 12:1e58bf51a0e5 | 13:3dad3f53402f |
|---|---|
| 25 top_n=args.top_n, | 25 top_n=args.top_n, |
| 26 max_links=args.max_links, | 26 max_links=args.max_links, |
| 27 score_cutoff=args.score_cutoff, | 27 score_cutoff=args.score_cutoff, |
| 28 link_method=args.link_method, | 28 link_method=args.link_method, |
| 29 keep_unconnected_nodes=args.keep_unconnected_nodes) | 29 keep_unconnected_nodes=args.keep_unconnected_nodes) |
| 30 score_name = next((s for s in scores.score_names if args.score_name in s and "score" in s), None) | |
| 31 if score_name is None: | |
| 32 raise ValueError(f"Could not find any score name containing '{args.score_name}'.") | |
| 30 | 33 |
| 31 network.create_network(scores, args.score_name) | 34 network.create_network(scores, score_name) |
| 32 network.export_to_file(filename=args.output_filename, graph_format=args.graph_format) | 35 network.export_to_file(filename=args.output_filename, graph_format=args.graph_format) |
| 33 | 36 |
| 34 return 0 | 37 return 0 |
| 35 | 38 |
| 36 | 39 |
