#!/usr/bin/env python3 from Bio import Entrez Entrez.email = 'another_email@gmail.com' import xml.etree.ElementTree as ET import json import os from dateutil import parser num_ids_for_request = 100 dir_metadata = 'metadata_from_nuccore' dir_fasta_and_yaml = 'fasta_and_yaml' dir_dict_ontology_standardization = 'dict_ontology_standardization/' path_ncbi_virus_accession = 'sequences.acc' def chunks(lst, n): for i in range(0, len(lst), n): yield lst[i:i + n] if not os.path.exists(dir_metadata): os.makedirs(dir_metadata) # Take all the ids id_set = set() term_list = ['SARS-CoV-2', 'SARS-CoV2', 'SARS CoV2', 'SARSCoV2', 'txid2697049[Organism]'] for term in term_list: tmp_list = Entrez.read( Entrez.esearch(db='nuccore', term=term, idtype='acc', retmax='10000') )['IdList'] # Remove mRNAs, ncRNAs, Proteins, and predicted models (more information here: https://en.wikipedia.org/wiki/RefSeq) tmp_list = [x for x in tmp_list if x[:2] not in ['NM', 'NR', 'NP', 'XM', 'XR', 'XP', 'WP']] # Remove the version in the id tmp_list = [x.split('.')[0] for x in tmp_list] print(term, len(tmp_list)) #tmp_list = tmp_list[0:2] # restricting to small run id_set.update([x.split('.')[0] for x in tmp_list]) print(term_list, len(id_set)) if os.path.exists(path_ncbi_virus_accession): with open(path_ncbi_virus_accession) as f: tmp_list = [line.strip('\n') for line in f] print('NCBI Virus', len(tmp_list)) id_set.update(tmp_list) term_list.append('NCBI Virus') print(term_list, len(id_set)) for i, id_x_list in enumerate(chunks(list(id_set), num_ids_for_request)): path_metadata_xxx_xml = os.path.join(dir_metadata, 'metadata_{}.xml'.format(i)) print('Requesting {} ids --> {}'.format(len(id_x_list), path_metadata_xxx_xml)) with open(path_metadata_xxx_xml, 'w') as fw: fw.write( Entrez.efetch(db='nuccore', id=id_x_list, retmode='xml').read() ) term_to_uri_dict = {} for path_dict_xxx_csv in [os.path.join(dir_dict_ontology_standardization, name_xxx_csv) for name_xxx_csv in os.listdir(dir_dict_ontology_standardization) if name_xxx_csv.endswith('.csv')]: print('Read {}'.format(path_dict_xxx_csv)) with open(path_dict_xxx_csv) as f: for line in f: if len(line.split(',')) > 2: term, uri = line.strip('\n').split('",') term = term.strip('"') else: term, uri = line.strip('\n').split(',') term_to_uri_dict[term] = uri species_to_taxid_dict = { 'Homo sapiens': 'http://purl.obolibrary.org/obo/NCBITaxon_9606' } if not os.path.exists(dir_fasta_and_yaml): os.makedirs(dir_fasta_and_yaml) missing_value_list = [] for path_metadata_xxx_xml in [os.path.join(dir_metadata, name_metadata_xxx_xml) for name_metadata_xxx_xml in os.listdir(dir_metadata) if name_metadata_xxx_xml.endswith('.xml')]: tree = ET.parse(path_metadata_xxx_xml) GBSet = tree.getroot() for GBSeq in GBSet: accession_version = GBSeq.find('GBSeq_accession-version').text GBSeq_sequence = GBSeq.find('GBSeq_sequence') if GBSeq_sequence is None: print(accession_version, ' - sequence not found') continue # A general default-empty yaml could be read from the definitive one info_for_yaml_dict = { 'id': 'placeholder', 'host': {}, 'sample': {}, 'virus': {}, 'technology': {}, 'submitter': {} } info_for_yaml_dict['sample']['sample_id'] = accession_version info_for_yaml_dict['sample']['source_database_accession'] = ["http://identifiers.org/insdc/"+accession_version+"#sequence"] #accession is turned into resolvable URL/URI now # submitter info GBSeq_references = GBSeq.find('GBSeq_references') if GBSeq_references is not None: info_for_yaml_dict['submitter']['authors'] = ["{}".format(x.text) for x in GBSeq_references.iter('GBAuthor')] GBReference = GBSeq_references.find('GBReference') if GBReference is not None: GBReference_journal = GBReference.find('GBReference_journal') if GBReference_journal is not None and GBReference_journal.text != 'Unpublished': if 'Submitted' in GBReference_journal.text: info_for_yaml_dict['submitter']['submitter_name'] = ["{}".format(GBReference_journal.text.split(') ')[1].split(',')[0].strip())] info_for_yaml_dict['submitter']['submitter_address'] = ','.join(GBReference_journal.text.split(') ')[1].split(',')[1:]).strip() else: info_for_yaml_dict['submitter']['additional_submitter_information'] = GBReference_journal.text GBSeq_comment = GBSeq.find('GBSeq_comment') if GBSeq_comment is not None and 'Assembly-Data' in GBSeq_comment.text: GBSeq_comment_text = GBSeq_comment.text.split('##Assembly-Data-START## ; ')[1].split(' ; ##Assembly-Data-END##')[0] for info_to_check, field_in_yaml in zip( ['Assembly Method', 'Coverage', 'Sequencing Technology'], ['sequence_assembly_method', 'sequencing_coverage', 'sample_sequencing_technology'] ): if info_to_check in GBSeq_comment_text: tech_info_to_parse = GBSeq_comment_text.split('{} :: '.format(info_to_check))[1].split(' ;')[0] if field_in_yaml == 'sequencing_coverage': # A regular expression would be better! try: info_for_yaml_dict['technology'][field_in_yaml] = [ float(tech_info_to_parse.strip('(average)').strip("reads/nt").strip('(average for 6 sequences)').replace(',', '.').strip(' xX>')) ] except ValueError: print(accession_version, "Couldn't make sense of Coverage '%s'" % tech_info_to_parse) pass elif field_in_yaml == 'sample_sequencing_technology': new_seq_tec_list = [] for seq_tec in tech_info_to_parse.split(';'): seq_tec = seq_tec.strip() if seq_tec in term_to_uri_dict: seq_tec = term_to_uri_dict[seq_tec] else: missing_value_list.append('\t'.join([accession_version, 'sample_sequencing_technology', seq_tec])) new_seq_tec_list.append(seq_tec) info_for_yaml_dict['technology']['sample_sequencing_technology'] = [x for x in new_seq_tec_list] else: info_for_yaml_dict['technology'][field_in_yaml] = tech_info_to_parse for GBFeature in GBSeq.iter('GBFeature'): if GBFeature.find('GBFeature_key').text != 'source': continue for GBQualifier in GBFeature.iter('GBQualifier'): GBQualifier_value = GBQualifier.find('GBQualifier_value') if GBQualifier_value is None: continue GBQualifier_value_text = GBQualifier_value.text GBQualifier_name_text = GBQualifier.find('GBQualifier_name').text if GBQualifier_name_text == 'host': GBQualifier_value_text_list = GBQualifier_value_text.split('; ') if GBQualifier_value_text_list[0] in species_to_taxid_dict: info_for_yaml_dict['host']['host_species'] = species_to_taxid_dict[GBQualifier_value_text_list[0]] if len(GBQualifier_value_text_list) > 1: if GBQualifier_value_text_list[1] in ['male', 'female']: if GBQualifier_value_text_list[1]=='male': info_for_yaml_dict['host']['host_sex'] = "http://purl.obolibrary.org/obo/PATO_0000384" elif GBQualifier_value_text_list[1]=='female': info_for_yaml_dict['host']['host_sex'] = "http://purl.obolibrary.org/obo/PATO_0000383" elif GBQualifier_value_text_list[1] in term_to_uri_dict: info_for_yaml_dict['host']['host_health_status'] = term_to_uri_dict[GBQualifier_value_text_list[1]] else: missing_value_list.append('\t'.join([accession_version, GBQualifier_name_text, GBQualifier_value_text_list[1]])) if 'age' in GBQualifier_value_text: info_for_yaml_dict['host']['host_age'] = int(GBQualifier_value_text_list[2].split('age ')[1]) info_for_yaml_dict['host']['host_age_unit'] = 'http://purl.obolibrary.org/obo/UO_0000036' elif GBQualifier_name_text == 'collected_by': if any([x in GBQualifier_value_text.lower() for x in ['institute', 'hospital', 'city', 'center']]): info_for_yaml_dict['sample']['collecting_institution'] = GBQualifier_value_text else: info_for_yaml_dict['sample']['collector_name'] = GBQualifier_value_text elif GBQualifier_name_text == 'isolation_source': if GBQualifier_value_text.upper() in term_to_uri_dict: GBQualifier_value_text = GBQualifier_value_text.upper() # For example, in case of 'usa: wa' if GBQualifier_value_text in term_to_uri_dict: info_for_yaml_dict['sample']['specimen_source'] = [term_to_uri_dict[GBQualifier_value_text]] else: if GBQualifier_value_text in ['NP/OP swab', 'nasopharyngeal and oropharyngeal swab', 'nasopharyngeal/oropharyngeal swab', 'np/np swab', 'np/op']: info_for_yaml_dict['sample']['specimen_source'] = [term_to_uri_dict['nasopharyngeal swab'], term_to_uri_dict['oropharyngeal swab']] elif GBQualifier_value_text in ['nasopharyngeal swab/throat swab', 'nasopharyngeal/throat swab']: info_for_yaml_dict['sample']['specimen_source'] = [term_to_uri_dict['nasopharyngeal swab'], term_to_uri_dict['throat swab']] elif GBQualifier_value_text in ['nasopharyngeal aspirate/throat swab']: info_for_yaml_dict['sample']['specimen_source'] = [term_to_uri_dict['nasopharyngeal aspirate'], term_to_uri_dict['throat swab']] else: missing_value_list.append('\t'.join([accession_version, 'specimen_source', GBQualifier_value_text])) elif GBQualifier_name_text == 'collection_date': # TO_DO: which format we will use? date_to_write = GBQualifier_value_text if len(GBQualifier_value_text.split('-')) == 1: if int(GBQualifier_value_text) < 2020: date_to_write = "15 12 {}".format(GBQualifier_value_text) else: date_to_write = "15 01 {}".format(GBQualifier_value_text) if 'additional_collection_information' in info_for_yaml_dict['sample']: info_for_yaml_dict['sample']['additional_collection_information'] += "; The 'collection_date' is estimated (the original date was: {})".format(GBQualifier_value_text) else: info_for_yaml_dict['sample']['additional_collection_information'] = "The 'collection_date' is estimated (the original date was: {})".format(GBQualifier_value_text) elif len(GBQualifier_value_text.split('-')) == 2: date_to_write += '-15' if 'additional_collection_information' in info_for_yaml_dict['sample']: info_for_yaml_dict['sample']['additional_collection_information'] += "; The 'collection_date' is estimated (the original date was: {})".format(GBQualifier_value_text) else: info_for_yaml_dict['sample']['additional_collection_information'] = "The 'collection_date' is estimated (the original date was: {})".format(GBQualifier_value_text) elif len(GBQualifier_value_text.split('-')) == 3: GBQualifier_value_text_list = GBQualifier_value_text.split('-') if GBQualifier_value_text_list[1].isalpha(): date_to_write = GBQualifier_value_text_list[1] + ' ' + GBQualifier_value_text_list[0] + ' ' + GBQualifier_value_text_list[2] info_for_yaml_dict['sample']['collection_date'] = date_to_write elif GBQualifier_name_text in ['lat_lon', 'country']: if GBQualifier_value_text == 'Hong Kong': GBQualifier_value_text = 'China: Hong Kong' if GBQualifier_value_text in term_to_uri_dict: GBQualifier_value_text = term_to_uri_dict[GBQualifier_value_text] else: missing_value_list.append('\t'.join([accession_version, GBQualifier_name_text, GBQualifier_value_text])) info_for_yaml_dict['sample']['collection_location'] = GBQualifier_value_text elif GBQualifier_name_text == 'note': if 'additional_collection_information' in info_for_yaml_dict['sample']: info_for_yaml_dict['sample']['additional_collection_information'] += '; ' + GBQualifier_value_text else: info_for_yaml_dict['sample']['additional_collection_information'] = GBQualifier_value_text elif GBQualifier_name_text == 'isolate': info_for_yaml_dict['virus']['virus_strain'] = GBQualifier_value_text elif GBQualifier_name_text == 'db_xref': info_for_yaml_dict['virus']['virus_species'] = "http://purl.obolibrary.org/obo/NCBITaxon_"+GBQualifier_value_text.split('taxon:')[1] # Remove technology key if empty! if (info_for_yaml_dict['technology']=={}): del info_for_yaml_dict['technology'] with open(os.path.join(dir_fasta_and_yaml, '{}.fasta'.format(accession_version)), 'w') as fw: fw.write('>{}\n{}'.format(accession_version, GBSeq_sequence.text.upper())) with open(os.path.join(dir_fasta_and_yaml, '{}.yaml'.format(accession_version)), 'w') as fw: json.dump(info_for_yaml_dict, fw, indent=2) if len(missing_value_list) > 0: with open('missing_terms.tsv', 'w') as fw: fw.write('\n'.join(missing_value_list))