Exploring the Role of Chemoinformatics in Accelerating Drug Discovery: A Computational Approach

Name: Work Video:
Duration: 3 min 30 s
Murali Aarthy; Umesh Panwar; Sanjeev Kumar Singh
{'id': 'https://openalex.org/W4386509167', 'doi': 'https://doi.org/10.1007/978-1-0716-3441-7_12', 'title': 'Exploring the Role of Chemoinformatics in Accelerating Drug Discovery: A Computational Approach', 'display_name': 'Exploring the Role of Chemoinformatics in Accelerating Drug Discovery: A Computational Approach', 'publication_year': 2023, 'publication_date': '2023-09-07', 'ids': {'openalex': 'https://openalex.org/W4386509167', 'doi': 'https://doi.org/10.1007/978-1-0716-3441-7_12', 'pmid': 'https://pubmed.ncbi.nlm.nih.gov/37676601'}, 'language': 'en', 'primary_location': {'is_oa': False, 'landing_page_url': 'https://doi.org/10.1007/978-1-0716-3441-7_12', 'pdf_url': None, 'source': {'id': 'https://openalex.org/S4210172139', 'display_name': 'Methods in molecular biology', 'issn_l': '1064-3745', 'issn': ['1064-3745', '1940-6029'], 'is_oa': False, 'is_in_doaj': False, 'is_core': True, 'host_organization': 'https://openalex.org/P4310319900', 'host_organization_name': 'Springer Science+Business Media', 'host_organization_lineage': ['https://openalex.org/P4310319965', 'https://openalex.org/P4310319900'], 'host_organization_lineage_names': ['Springer Nature', 'Springer Science+Business Media'], 'type': 'book series'}, 'license': None, 'license_id': None, 'version': None, 'is_accepted': False, 'is_published': False}, 'type': 'article', 'type_crossref': 'book-chapter', 'indexed_in': ['crossref', 'pubmed'], 'open_access': {'is_oa': False, 'oa_status': 'closed', 'oa_url': None, 'any_repository_has_fulltext': False}, 'authorships': [{'author_position': 'first', 'author': {'id': 'https://openalex.org/A5049721522', 'display_name': 'Murali Aarthy', 'orcid': None}, 'institutions': [{'id': 'https://openalex.org/I131155284', 'display_name': 'Alagappa University', 'ror': 'https://ror.org/04ec9cc06', 'country_code': 'IN', 'type': 'education', 'lineage': ['https://openalex.org/I131155284']}], 'countries': ['IN'], 'is_corresponding': False, 'raw_author_name': 'Aarthy Murali', 'raw_affiliation_strings': ['Computer Aided Drug Design and Molecular Modelling Lab, Department of Bioinformatics, Science Block, Alagappa University, Karaikudi, Tamil Nadu, India'], 'affiliations': [{'raw_affiliation_string': 'Computer Aided Drug Design and Molecular Modelling Lab, Department of Bioinformatics, Science Block, Alagappa University, Karaikudi, Tamil Nadu, India', 'institution_ids': ['https://openalex.org/I131155284']}]}, {'author_position': 'middle', 'author': {'id': 'https://openalex.org/A5029236328', 'display_name': 'Umesh Panwar', 'orcid': 'https://orcid.org/0000-0001-7777-7174'}, 'institutions': [{'id': 'https://openalex.org/I131155284', 'display_name': 'Alagappa University', 'ror': 'https://ror.org/04ec9cc06', 'country_code': 'IN', 'type': 'education', 'lineage': ['https://openalex.org/I131155284']}], 'countries': ['IN'], 'is_corresponding': False, 'raw_author_name': 'Umesh Panwar', 'raw_affiliation_strings': ['Computer Aided Drug Design and Molecular Modelling Lab, Department of Bioinformatics, Science Block, Alagappa University, Karaikudi, Tamil Nadu, India'], 'affiliations': [{'raw_affiliation_string': 'Computer Aided Drug Design and Molecular Modelling Lab, Department of Bioinformatics, Science Block, Alagappa University, Karaikudi, Tamil Nadu, India', 'institution_ids': ['https://openalex.org/I131155284']}]}, {'author_position': 'last', 'author': {'id': 'https://openalex.org/A5054825291', 'display_name': 'Sanjeev Kumar Singh', 'orcid': 'https://orcid.org/0000-0003-4153-6437'}, 'institutions': [{'id': 'https://openalex.org/I4210161010', 'display_name': 'Centre of Biomedical Research', 'ror': 'https://ror.org/05xkqnm68', 'country_code': 'IN', 'type': 'facility', 'lineage': ['https://openalex.org/I4210161010']}, {'id': 'https://openalex.org/I161370692', 'display_name': 'Sanjay Gandhi Post Graduate Institute of Medical Sciences', 'ror': 'https://ror.org/01rsgrz10', 'country_code': 'IN', 'type': 'facility', 'lineage': ['https://openalex.org/I161370692']}], 'countries': ['IN'], 'is_corresponding': False, 'raw_author_name': 'Sanjeev Kumar Singh', 'raw_affiliation_strings': ['Department of Data Sciences, Centre of Biomedical Research, SGPGIMS Campus, Lucknow, Uttar Pradesh, India'], 'affiliations': [{'raw_affiliation_string': 'Department of Data Sciences, Centre of Biomedical Research, SGPGIMS Campus, Lucknow, Uttar Pradesh, India', 'institution_ids': ['https://openalex.org/I4210161010', 'https://openalex.org/I161370692']}]}], 'institution_assertions': [], 'countries_distinct_count': 1, 'institutions_distinct_count': 3, 'corresponding_author_ids': [], 'corresponding_institution_ids': [], 'apc_list': None, 'apc_paid': None, 'fwci': 0.0, 'has_fulltext': False, 'cited_by_count': 0, 'citation_normalized_percentile': {'value': 0.0, 'is_in_top_1_percent': False, 'is_in_top_10_percent': False}, 'cited_by_percentile_year': {'min': 0, 'max': 67}, 'biblio': {'volume': None, 'issue': None, 'first_page': '203', 'last_page': '213'}, 'is_retracted': False, 'is_paratext': False, 'primary_topic': {'id': 'https://openalex.org/T10211', 'display_name': 'Computational Drug Discovery Methods', 'score': 0.9999, 'subfield': {'id': 'https://openalex.org/subfields/1703', 'display_name': 'Computational Theory and Mathematics'}, 'field': {'id': 'https://openalex.org/fields/17', 'display_name': 'Computer Science'}, 'domain': {'id': 'https://openalex.org/domains/3', 'display_name': 'Physical Sciences'}}, 'topics': [{'id': 'https://openalex.org/T10211', 'display_name': 'Computational Drug Discovery Methods', 'score': 0.9999, 'subfield': {'id': 'https://openalex.org/subfields/1703', 'display_name': 'Computational Theory and Mathematics'}, 'field': {'id': 'https://openalex.org/fields/17', 'display_name': 'Computer Science'}, 'domain': {'id': 'https://openalex.org/domains/3', 'display_name': 'Physical Sciences'}}, {'id': 'https://openalex.org/T13937', 'display_name': 'Genetics, Bioinformatics, and Biomedical Research', 'score': 0.9613, 'subfield': {'id': 'https://openalex.org/subfields/1312', 'display_name': 'Molecular Biology'}, 'field': {'id': 'https://openalex.org/fields/13', 'display_name': 'Biochemistry, Genetics and Molecular Biology'}, 'domain': {'id': 'https://openalex.org/domains/1', 'display_name': 'Life Sciences'}}, {'id': 'https://openalex.org/T10887', 'display_name': 'Bioinformatics and Genomic Networks', 'score': 0.9304, 'subfield': {'id': 'https://openalex.org/subfields/1312', 'display_name': 'Molecular Biology'}, 'field': {'id': 'https://openalex.org/fields/13', 'display_name': 'Biochemistry, Genetics and Molecular Biology'}, 'domain': {'id': 'https://openalex.org/domains/1', 'display_name': 'Life Sciences'}}], 'keywords': [{'id': 'https://openalex.org/keywords/cheminformatics', 'display_name': 'Cheminformatics', 'score': 0.99618286}], 'concepts': [{'id': 'https://openalex.org/C68762167', 'wikidata': 'https://www.wikidata.org/wiki/Q910164', 'display_name': 'Cheminformatics', 'level': 2, 'score': 0.99618286}, {'id': 'https://openalex.org/C74187038', 'wikidata': 'https://www.wikidata.org/wiki/Q1418791', 'display_name': 'Drug discovery', 'level': 2, 'score': 0.75390697}, {'id': 'https://openalex.org/C2522767166', 'wikidata': 'https://www.wikidata.org/wiki/Q2374463', 'display_name': 'Data science', 'level': 1, 'score': 0.60038537}, {'id': 'https://openalex.org/C41008148', 'wikidata': 'https://www.wikidata.org/wiki/Q21198', 'display_name': 'Computer science', 'level': 0, 'score': 0.5413972}, {'id': 'https://openalex.org/C9652623', 'wikidata': 'https://www.wikidata.org/wiki/Q190109', 'display_name': 'Field (mathematics)', 'level': 2, 'score': 0.43584386}, {'id': 'https://openalex.org/C70721500', 'wikidata': 'https://www.wikidata.org/wiki/Q177005', 'display_name': 'Computational biology', 'level': 1, 'score': 0.391028}, {'id': 'https://openalex.org/C183696295', 'wikidata': 'https://www.wikidata.org/wiki/Q2487696', 'display_name': 'Biochemical engineering', 'level': 1, 'score': 0.3569443}, {'id': 'https://openalex.org/C60644358', 'wikidata': 'https://www.wikidata.org/wiki/Q128570', 'display_name': 'Bioinformatics', 'level': 1, 'score': 0.2477211}, {'id': 'https://openalex.org/C127413603', 'wikidata': 'https://www.wikidata.org/wiki/Q11023', 'display_name': 'Engineering', 'level': 0, 'score': 0.19640666}, {'id': 'https://openalex.org/C86803240', 'wikidata': 'https://www.wikidata.org/wiki/Q420', 'display_name': 'Biology', 'level': 0, 'score': 0.16239351}, {'id': 'https://openalex.org/C33923547', 'wikidata': 'https://www.wikidata.org/wiki/Q395', 'display_name': 'Mathematics', 'level': 0, 'score': 0.12680563}, {'id': 'https://openalex.org/C202444582', 'wikidata': 'https://www.wikidata.org/wiki/Q837863', 'display_name': 'Pure mathematics', 'level': 1, 'score': 0.0}], 'mesh': [{'descriptor_ui': 'D000080911', 'descriptor_name': 'Cheminformatics', 'qualifier_ui': '', 'qualifier_name': None, 'is_major_topic': True}, {'descriptor_ui': 'D055808', 'descriptor_name': 'Drug Discovery', 'qualifier_ui': '', 'qualifier_name': None, 'is_major_topic': True}, {'descriptor_ui': 'D000076722', 'descriptor_name': 'Drug Development', 'qualifier_ui': '', 'qualifier_name': None, 'is_major_topic': False}], 'locations_count': 2, 'locations': [{'is_oa': False, 'landing_page_url': 'https://doi.org/10.1007/978-1-0716-3441-7_12', 'pdf_url': None, 'source': {'id': 'https://openalex.org/S4210172139', 'display_name': 'Methods in molecular biology', 'issn_l': '1064-3745', 'issn': ['1064-3745', '1940-6029'], 'is_oa': False, 'is_in_doaj': False, 'is_core': True, 'host_organization': 'https://openalex.org/P4310319900', 'host_organization_name': 'Springer Science+Business Media', 'host_organization_lineage': ['https://openalex.org/P4310319965', 'https://openalex.org/P4310319900'], 'host_organization_lineage_names': ['Springer Nature', 'Springer Science+Business Media'], 'type': 'book series'}, 'license': None, 'license_id': None, 'version': None, 'is_accepted': False, 'is_published': False}, {'is_oa': False, 'landing_page_url': 'https://pubmed.ncbi.nlm.nih.gov/37676601', 'pdf_url': None, 'source': {'id': 'https://openalex.org/S4306525036', 'display_name': 'PubMed', 'issn_l': None, 'issn': None, 'is_oa': False, 'is_in_doaj': False, 'is_core': False, 'host_organization': 'https://openalex.org/I1299303238', 'host_organization_name': 'National Institutes of Health', 'host_organization_lineage': ['https://openalex.org/I1299303238'], 'host_organization_lineage_names': ['National Institutes of Health'], 'type': 'repository'}, 'license': None, 'license_id': None, 'version': None, 'is_accepted': False, 'is_published': False}], 'best_oa_location': None, 'sustainable_development_goals': [], 'grants': [], 'datasets': [], 'versions': [], 'referenced_works_count': 69, 'referenced_works': ['https://openalex.org/W1981435730', 'https://openalex.org/W1988195734', 'https://openalex.org/W1988429360', 'https://openalex.org/W1991061605', 'https://openalex.org/W1993496827', 'https://openalex.org/W1996327711', 'https://openalex.org/W2012081137', 'https://openalex.org/W2036346640', 'https://openalex.org/W2038982802', 'https://openalex.org/W2046613566', 'https://openalex.org/W2054743669', 'https://openalex.org/W2062866883', 'https://openalex.org/W2065263819', 'https://openalex.org/W2077140561', 'https://openalex.org/W2096541451', 'https://openalex.org/W2124001239', 'https://openalex.org/W2124733207', 'https://openalex.org/W2125253492', 'https://openalex.org/W2134648236', 'https://openalex.org/W2140972311', 'https://openalex.org/W2163302303', 'https://openalex.org/W2166648207', 'https://openalex.org/W2172024214', 'https://openalex.org/W2291135949', 'https://openalex.org/W2317928565', 'https://openalex.org/W2396787206', 'https://openalex.org/W2467268987', 'https://openalex.org/W2489680504', 'https://openalex.org/W2747311978', 'https://openalex.org/W2769941021', 'https://openalex.org/W2792233460', 'https://openalex.org/W2795151481', 'https://openalex.org/W2799656935', 'https://openalex.org/W2801991413', 'https://openalex.org/W2900090807', 'https://openalex.org/W2900477409', 'https://openalex.org/W2902954978', 'https://openalex.org/W2908728320', 'https://openalex.org/W2935776585', 'https://openalex.org/W2964677890', 'https://openalex.org/W2974669982', 'https://openalex.org/W2991074074', 'https://openalex.org/W2998322952', 'https://openalex.org/W3005998465', 'https://openalex.org/W3029583050', 'https://openalex.org/W3030193057', 'https://openalex.org/W3039633850', 'https://openalex.org/W3083535621', 'https://openalex.org/W3090005544', 'https://openalex.org/W3091215579', 'https://openalex.org/W3095720306', 'https://openalex.org/W3100751385', 'https://openalex.org/W3115142961', 'https://openalex.org/W3116869419', 'https://openalex.org/W3119493813', 'https://openalex.org/W3120469917', 'https://openalex.org/W3127831912', 'https://openalex.org/W3168975505', 'https://openalex.org/W3194368700', 'https://openalex.org/W3205928666', 'https://openalex.org/W4214911520', 'https://openalex.org/W4220686242', 'https://openalex.org/W4281732955', 'https://openalex.org/W4295012037', 'https://openalex.org/W4309441503', 'https://openalex.org/W4311904335', 'https://openalex.org/W4312305591', 'https://openalex.org/W4313244365', 'https://openalex.org/W4367049415'], 'related_works': ['https://openalex.org/W4386509167', 'https://openalex.org/W4376484878', 'https://openalex.org/W4200184670', 'https://openalex.org/W3165034028', 'https://openalex.org/W2917626761', 'https://openalex.org/W2889938001', 'https://openalex.org/W2751692355', 'https://openalex.org/W2070692310', 'https://openalex.org/W1964657534', 'https://openalex.org/W1573015311'], 'abstract_inverted_index': None, 'cited_by_api_url': 'https://api.openalex.org/works?filter=cites:W4386509167', 'counts_by_year': [], 'updated_date': '2025-01-05T17:52:51.485831', 'created_date': '2023-09-08'}
Publication Information

Basic Information

Access and Citation

AI Researcher Chatbot

Primary Location

Authors

Topics

Keywords

Related Works
