annotate process_input.py @ 0:7f669682f4ac draft

planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
author iuc
date Mon, 06 Oct 2025 12:13:07 +0000
parents
children
Ignore whitespace changes - Everywhere: Within whitespace: At end of lines:
rev   line source
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7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
iuc
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1 import json
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
iuc
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2 import os
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
iuc
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3 import sys
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
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7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
iuc
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5 import yaml
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
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7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
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7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
iuc
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8 def get_section_string(f, start_line, end_line, return_string=False):
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
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9 # consume starting lines
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
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10 start_string = iter(f.readline, start_line)
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
iuc
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11 start_string = ''.join(line for line in start_string)
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
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12 # read YAML lines
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
iuc
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13 yaml_string = iter(f.readline, end_line)
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
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14 if return_string:
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
iuc
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15 return ''.join(x for x in yaml_string)
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
iuc
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16 else:
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
iuc
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17 return [x for x in yaml_string]
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
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7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
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7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
iuc
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20 def fill_from_yaml_data(yaml_only_dict, studies_samples_dict):
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
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21 # fill experiment information (platform)
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
iuc
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22 for index, exp in yaml_only_dict['ENA_experiment'].items():
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
iuc
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23 study_alias = exp['study_alias']
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
iuc
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24 sample_alias = exp['sample_alias']
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
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25 if study_alias in studies_samples_dict.keys():
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
iuc
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26 if sample_alias in studies_samples_dict[study_alias].keys():
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
iuc
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27 studies_samples_dict[study_alias][sample_alias]['experiments'].append({'platform': exp['platform']})
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
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28 else:
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
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29 studies_samples_dict[study_alias][sample_alias] = {'experiments': [{'platform': exp['platform']}]}
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
iuc
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30 else:
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
iuc
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31 studies_samples_dict[study_alias] = {
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
iuc
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32 sample_alias: {'experiments': [{'platform': exp['platform']}]}
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
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33 }
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
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34
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
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35
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
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36 def load_receipt_data(input_file_path):
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
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37 # should do some health check of the input file?
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
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38 # load yaml section
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
iuc
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39 loaded_data = {}
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
iuc
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40 yaml_delimiter = 'YAML -------------\n'
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
iuc
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41 with open(input_file_path) as input_file:
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
iuc
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42 yaml_only_section = yaml.safe_load(
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
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43 get_section_string(input_file, start_line=yaml_delimiter, end_line=yaml_delimiter, return_string=True)
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
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44 )
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
iuc
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45 fill_from_yaml_data(yaml_only_section, loaded_data)
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
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46 # read study accessions
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
iuc
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47 study_delimiter = 'Study accession details:\n'
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
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48 end_line = '\n'
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
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49 with open(input_file_path) as input_file:
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
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50 studies_accession_lines = get_section_string(input_file, start_line=study_delimiter, end_line=end_line)
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
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51
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
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52 for study_line in studies_accession_lines:
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
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53 if study_line != '\n':
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
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54 alias, accession, *_ = study_line.split('\t')
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
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55 try:
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
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56 loaded_data[alias]['accession'] = accession
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
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57 except KeyError:
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
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58 print(f"Experiment {alias} has unknown study or sample")
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
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59
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
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60 samples_delimiter = 'Sample accession details:\n'
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
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61 with open(input_file_path) as input_file:
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
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62 samples_accession_lines = get_section_string(input_file, start_line=samples_delimiter, end_line=end_line)
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
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63
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64 for sample_line in samples_accession_lines:
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
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65 if sample_line != '\n':
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
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66 alias, accession, *_ = sample_line.split('\t')
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
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67 for study in loaded_data.keys():
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
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68 if alias in loaded_data[study].keys():
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
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69 loaded_data[study][alias]['accession'] = accession
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
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70 break
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
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71
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72 return loaded_data
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
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73
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74
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75 def main():
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
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76 input_file_path = sys.argv[1]
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
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77 fasta_names_list_path = sys.argv[2]
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
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78 out_manifest_base = sys.argv[3]
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
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79 manifest_template = sys.argv[4]
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
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80
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
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81 # load submitted data from receipt file
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
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82 data_dict = load_receipt_data(input_file_path)
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
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83
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84 # iterate over the list of fasta files
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
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85 with open(fasta_names_list_path, 'r') as fasta_files_json_file:
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
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86 fasta_files_list = json.load(fasta_files_json_file)
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
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87
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
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88 with open('submit_list.tab', 'w') as written_manifests_out:
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
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89 for fasta_file in fasta_files_list:
7f669682f4ac planemo upload for repository https://github.com/galaxyproject/tools-iuc/tree/main/tools/ena_webin_cli commit abb15194a196267142d88b9348facf9e85e601ef
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90 if fasta_file.endswith('.fasta.gz'):
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91 sample_alias = fasta_file[:-9]
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92 else:
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93 sample_alias = fasta_file[:-6]
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94
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95 print(f'Processing {sample_alias}')
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96 found_metadata = False
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97
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98 for study_alias in data_dict.keys():
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99 if sample_alias in data_dict[study_alias].keys():
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100 sample_accession = data_dict[study_alias][sample_alias]['accession']
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101 study_accession = data_dict[study_alias]['accession']
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102 # TODO: get a string that concatenates platform information from multiple experiments
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103 platform = data_dict[study_alias][sample_alias]['experiments'][0]['platform']
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104 manifest_path = os.path.join(out_manifest_base, sample_alias + '.manifest.txt')
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105
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106 with open(manifest_path, "w") as output_handle:
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107 # dump the contents of manifest template containing global vars
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108 with open(manifest_template) as m_template:
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109 output_handle.write(m_template.read())
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110
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111 output_handle.write("ASSEMBLYNAME\tconsensus_" + sample_alias + "\n")
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112 output_handle.write("PLATFORM\t" + platform + "\n")
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113 output_handle.write("STUDY\t" + study_accession + "\n")
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114 output_handle.write("SAMPLE\t" + sample_accession + "\n")
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115 output_handle.write("FASTA\t" + sample_alias + '.fasta.gz' + "\n")
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116 agp_path = os.path.join("./fasta", sample_alias + ".agp")
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117 if os.path.exists(agp_path):
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118 output_handle.write("AGP\t" + sample_alias + ".agp\n")
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119 chr_list_path = os.path.join("./fasta", sample_alias + ".tsv.gz")
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120 if os.path.exists(chr_list_path):
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121 output_handle.write("CHROMOSOME_LIST\t" + sample_alias + ".tsv.gz\n")
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122
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123 found_metadata = True
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124 written_manifests_out.write(manifest_path + '\n')
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125 break
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126
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127 if not found_metadata:
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128 print(f'No metadata found for sample {sample_alias}')
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129
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130
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131 if __name__ == '__main__':
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132 main()