{"id":"https://openalex.org/W4285133238","doi":"https://doi.org/10.1016/b978-0-323-90608-1.00006-x","title":"Limitations and future challenges of computer-aided drug design methods","display_name":"Limitations and future challenges of computer-aided drug design methods","publication_year":2022,"publication_date":"2022-01-01","ids":{"openalex":"https://openalex.org/W4285133238","doi":"https://doi.org/10.1016/b978-0-323-90608-1.00006-x"},"language":"en","primary_location":{"id":"doi:10.1016/b978-0-323-90608-1.00006-x","doi":"https://doi.org/10.1016/b978-0-323-90608-1.00006-x","is_oa":false,"landing_page_url":"https://doi.org/10.1016/b978-0-323-90608-1.00006-x","pdf_url":null,"source":{"id":"https://openalex.org/S4306463230","display_name":"Elsevier eBooks","issn_l":null,"issn":null,"is_oa":false,"is_in_doaj":false,"is_core":false,"listed_in":[],"host_organization":"https://openalex.org/P4310320990","host_organization_name":"Elsevier BV","host_organization_lineage":["https://openalex.org/P4310320990"],"host_organization_lineage_names":["Elsevier BV"],"type":"ebook platform"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Computer Aided Drug Design (CADD): From Ligand-Based Methods to Structure-Based Approaches","raw_type":"book-chapter"},"volume":{"id":"https://openalex.org/W4285162151","display_name":"Computer Aided Drug Design (CADD): From Ligand-Based Methods to Structure-Based Approaches"},"type":"book-chapter","indexed_in":["crossref"],"open_access":{"is_oa":false,"oa_status":"closed","oa_url":null,"any_repository_has_fulltext":false},"authorships":[{"author_position":"first","author":{"id":"https://openalex.org/A5050741596","display_name":"Ashish Harish Shah","orcid":"https://orcid.org/0000-0002-0183-1274","observed_orcids":["https://orcid.org/0000-0002-0183-1274"]},"institutions":[{"id":"https://openalex.org/I4210119093","display_name":"Suamandeep Vidyapeeth University","ror":"https://ror.org/02mpq1w39","country_code":"IN","type":"education","lineage":["https://openalex.org/I4210119093"]}],"countries":["IN"],"is_corresponding":false,"raw_author_name":"Ashish Shah","raw_affiliation_strings":["Department of Pharmacy, Sumandeep Vidyapeeth, Vadodara, Gujarat, India"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Pharmacy, Sumandeep Vidyapeeth, Vadodara, Gujarat, India","institution_ids":["https://openalex.org/I4210119093"]}]},{"author_position":"last","author":{"id":"https://openalex.org/A5052604778","display_name":"Manav Jain","orcid":"https://orcid.org/0000-0002-6365-8411","observed_orcids":["https://orcid.org/0000-0002-6365-8411","https://orcid.org/0000-0002-0933-490X"]},"institutions":[{"id":"https://openalex.org/I45294948","display_name":"Post Graduate Institute of Medical Education and Research","ror":"https://ror.org/009nfym65","country_code":"IN","type":"education","lineage":["https://openalex.org/I45294948"]}],"countries":["IN"],"is_corresponding":false,"raw_author_name":"Manav Jain","raw_affiliation_strings":["Department of Pharmacology, Postgraduate Institute of Medical Education and Research, Chandigarh, Punjab, India"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Pharmacology, Postgraduate Institute of Medical Education and Research, Chandigarh, Punjab, India","institution_ids":["https://openalex.org/I45294948"]}]}],"institutions":[],"countries_distinct_count":1,"institutions_distinct_count":2,"corresponding_author_ids":[],"corresponding_institution_ids":[],"apc_list":null,"apc_paid":null,"fwci":26.7797,"has_fulltext":false,"cited_by_count":44,"citation_normalized_percentile":{"value":0.99802137,"is_in_top_1_percent":true,"is_in_top_10_percent":true},"cited_by_percentile_year":{"min":97,"max":100},"biblio":{"volume":null,"issue":null,"first_page":"283","last_page":"297"},"is_retracted":false,"is_paratext":false,"is_xpac":false,"primary_topic":{"id":"https://openalex.org/T10211","display_name":"Computational Drug Discovery Methods","score":1.0,"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":1.0,"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/T14099","display_name":"Synthesis and Characterization of Heterocyclic Compounds","score":0.0,"subfield":{"id":"https://openalex.org/subfields/1605","display_name":"Organic Chemistry"},"field":{"id":"https://openalex.org/fields/16","display_name":"Chemistry"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}},{"id":"https://openalex.org/T12023","display_name":"Cholinesterase and Neurodegenerative Diseases","score":0.0,"subfield":{"id":"https://openalex.org/subfields/2736","display_name":"Pharmacology (medical)"},"field":{"id":"https://openalex.org/fields/27","display_name":"Medicine"},"domain":{"id":"https://openalex.org/domains/4","display_name":"Health Sciences"}}],"keywords":[{"id":"https://openalex.org/keywords/computer-aided-drug-design","display_name":"computer-aided drug design","score":0.9990000128746033},{"id":"https://openalex.org/keywords/computational-methods","display_name":"computational methods","score":0.4959999918937683},{"id":"https://openalex.org/keywords/drug-discovery","display_name":"drug discovery","score":0.5669999718666077},{"id":"https://openalex.org/keywords/molecular-optimization","display_name":"molecular optimization","score":0.628000020980835},{"id":"https://openalex.org/keywords/virtual-screening","display_name":"virtual screening","score":0.7239999771118164}],"concepts":[{"id":"https://openalex.org/C2780916735","wikidata":"https://www.wikidata.org/wiki/Q669584","display_name":"Prospectus","level":2,"score":0.6670184135437012},{"id":"https://openalex.org/C41008148","wikidata":"https://www.wikidata.org/wiki/Q21198","display_name":"Computer science","level":0,"score":0.6631736159324646},{"id":"https://openalex.org/C2780727963","wikidata":"https://www.wikidata.org/wiki/Q5157368","display_name":"Computer-aided","level":2,"score":0.5749698281288147},{"id":"https://openalex.org/C119823426","wikidata":"https://www.wikidata.org/wiki/Q184793","display_name":"Computer Aided Design","level":2,"score":0.49407246708869934},{"id":"https://openalex.org/C112930515","wikidata":"https://www.wikidata.org/wiki/Q4389547","display_name":"Risk analysis (engineering)","level":1,"score":0.41482222080230713},{"id":"https://openalex.org/C183696295","wikidata":"https://www.wikidata.org/wiki/Q2487696","display_name":"Biochemical engineering","level":1,"score":0.3773846924304962},{"id":"https://openalex.org/C201995342","wikidata":"https://www.wikidata.org/wiki/Q682496","display_name":"Systems engineering","level":1,"score":0.34204915165901184},{"id":"https://openalex.org/C127413603","wikidata":"https://www.wikidata.org/wiki/Q11023","display_name":"Engineering","level":0,"score":0.23595115542411804},{"id":"https://openalex.org/C71924100","wikidata":"https://www.wikidata.org/wiki/Q11190","display_name":"Medicine","level":0,"score":0.09842324256896973},{"id":"https://openalex.org/C111919701","wikidata":"https://www.wikidata.org/wiki/Q9135","display_name":"Operating system","level":1,"score":0.0},{"id":"https://openalex.org/C199360897","wikidata":"https://www.wikidata.org/wiki/Q9143","display_name":"Programming language","level":1,"score":0.0},{"id":"https://openalex.org/C10138342","wikidata":"https://www.wikidata.org/wiki/Q43015","display_name":"Finance","level":1,"score":0.0},{"id":"https://openalex.org/C162324750","wikidata":"https://www.wikidata.org/wiki/Q8134","display_name":"Economics","level":0,"score":0.0}],"mesh":[],"locations_count":1,"locations":[{"id":"doi:10.1016/b978-0-323-90608-1.00006-x","doi":"https://doi.org/10.1016/b978-0-323-90608-1.00006-x","is_oa":false,"landing_page_url":"https://doi.org/10.1016/b978-0-323-90608-1.00006-x","pdf_url":null,"source":{"id":"https://openalex.org/S4306463230","display_name":"Elsevier eBooks","issn_l":null,"issn":null,"is_oa":false,"is_in_doaj":false,"is_core":false,"listed_in":[],"host_organization":"https://openalex.org/P4310320990","host_organization_name":"Elsevier BV","host_organization_lineage":["https://openalex.org/P4310320990"],"host_organization_lineage_names":["Elsevier BV"],"type":"ebook platform"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Computer Aided Drug Design (CADD): From Ligand-Based Methods to Structure-Based Approaches","raw_type":"book-chapter"}],"best_oa_location":null,"sustainable_development_goals":[],"study_designs":[],"awards":[],"funders":[],"has_content":{"pdf":false,"grobid_xml":false},"content_urls":null,"referenced_works_count":45,"referenced_works":["https://openalex.org/W1255705275","https://openalex.org/W1974590528","https://openalex.org/W1974645077","https://openalex.org/W1984021058","https://openalex.org/W1986240377","https://openalex.org/W1987012451","https://openalex.org/W1997932321","https://openalex.org/W2005817231","https://openalex.org/W2008732224","https://openalex.org/W2037320233","https://openalex.org/W2045167826","https://openalex.org/W2049899751","https://openalex.org/W2061007134","https://openalex.org/W2083110179","https://openalex.org/W2086748420","https://openalex.org/W2088226047","https://openalex.org/W2091111431","https://openalex.org/W2094162409","https://openalex.org/W2095842646","https://openalex.org/W2098530568","https://openalex.org/W2112411768","https://openalex.org/W2112579204","https://openalex.org/W2125792789","https://openalex.org/W2126099392","https://openalex.org/W2154662590","https://openalex.org/W2155275960","https://openalex.org/W2158996088","https://openalex.org/W2163258948","https://openalex.org/W2172035234","https://openalex.org/W2180898434","https://openalex.org/W2210622668","https://openalex.org/W2231776028","https://openalex.org/W2345198528","https://openalex.org/W2494768458","https://openalex.org/W2554099577","https://openalex.org/W2608559058","https://openalex.org/W2746774070","https://openalex.org/W2786092929","https://openalex.org/W2801871022","https://openalex.org/W2892083369","https://openalex.org/W2901719664","https://openalex.org/W2963436022","https://openalex.org/W3014108899","https://openalex.org/W3045100294","https://openalex.org/W6684056950"],"related_works":["https://openalex.org/W4376630162","https://openalex.org/W2181408002","https://openalex.org/W4407725066","https://openalex.org/W2918813360","https://openalex.org/W4400687435","https://openalex.org/W6911385570","https://openalex.org/W7101410223","https://openalex.org/W1969631507","https://openalex.org/W7213674270","https://openalex.org/W3199068480"],"abstract_inverted_index":null,"counts_by_year":[{"year":2026,"cited_by_count":9},{"year":2025,"cited_by_count":15},{"year":2024,"cited_by_count":15},{"year":2023,"cited_by_count":5}],"updated_date":"2026-11-04T10:54:05.112534","created_date":"2022-07-14T00:00:00"}