{"id":"https://openalex.org/W2162723974","doi":"https://doi.org/10.1093/bioinformatics/bts186","title":"e-Drug3D: 3D structure collections dedicated to drug repurposing and fragment-based drug design","display_name":"e-Drug3D: 3D structure collections dedicated to drug repurposing and fragment-based drug design","publication_year":2012,"publication_date":"2012-04-26","ids":{"openalex":"https://openalex.org/W2162723974","doi":"https://doi.org/10.1093/bioinformatics/bts186","mag":"2162723974","pmid":"https://pubmed.ncbi.nlm.nih.gov/22539672"},"language":"en","primary_location":{"id":"doi:10.1093/bioinformatics/bts186","is_oa":true,"landing_page_url":"https://doi.org/10.1093/bioinformatics/bts186","pdf_url":"https://academic.oup.com/bioinformatics/article-pdf/28/11/1540/48868517/bioinformatics_28_11_1540.pdf","source":{"id":"https://openalex.org/S52395412","display_name":"Bioinformatics","issn_l":"1367-4803","issn":["1367-4803","1367-4811"],"is_oa":false,"is_in_doaj":true,"is_core":true,"host_organization":"https://openalex.org/P4310311648","host_organization_name":"Oxford University Press","host_organization_lineage":["https://openalex.org/P4310311648","https://openalex.org/P4310311647"],"host_organization_lineage_names":["Oxford University Press","University of Oxford"],"type":"journal"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Bioinformatics","raw_type":"journal-article"},"type":"article","indexed_in":["crossref","doaj","pubmed"],"open_access":{"is_oa":true,"oa_status":"bronze","oa_url":"https://academic.oup.com/bioinformatics/article-pdf/28/11/1540/48868517/bioinformatics_28_11_1540.pdf","any_repository_has_fulltext":false},"authorships":[{"author_position":"first","author":{"id":"https://openalex.org/A5044567900","display_name":"\u00c9milie Pihan","orcid":"https://orcid.org/0000-0002-2632-5570"},"institutions":[{"id":"https://openalex.org/I4210160500","display_name":"Institut de Pharmacologie Mol\u00e9culaire et Cellulaire","ror":"https://ror.org/05k4ema52","country_code":"FR","type":"facility","lineage":["https://openalex.org/I1294671590","https://openalex.org/I1294671590","https://openalex.org/I201841394","https://openalex.org/I4210096427","https://openalex.org/I4210160500"]},{"id":"https://openalex.org/I19894307","display_name":"Universit\u00e9 de Montpellier","ror":"https://ror.org/051escj72","country_code":"FR","type":"education","lineage":["https://openalex.org/I19894307"]},{"id":"https://openalex.org/I4210100279","display_name":"Centre de Biologie Structurale","ror":"https://ror.org/0189yvq06","country_code":"FR","type":"facility","lineage":["https://openalex.org/I1294671590","https://openalex.org/I154526488","https://openalex.org/I19894307","https://openalex.org/I4210100279"]},{"id":"https://openalex.org/I154526488","display_name":"Inserm","ror":"https://ror.org/02vjkv261","country_code":"FR","type":"funder","lineage":["https://openalex.org/I154526488"]},{"id":"https://openalex.org/I1294671590","display_name":"Centre National de la Recherche Scientifique","ror":"https://ror.org/02feahw73","country_code":"FR","type":"funder","lineage":["https://openalex.org/I1294671590"]}],"countries":["FR"],"is_corresponding":true,"raw_author_name":"Emilie Pihan","raw_affiliation_strings":["1 Institut de Pharmacologie Mol\u00e9culaire et Cellulaire, CNRS UMR7275, Universit\u00e9 Nice \u2013 Sophia Antipolis, 660, route des lucioles 06560 Valbonne and 2Centre de Biochimie Structurale, INSERM U1054, CNRS UMR5048 \u2013 Universit\u00e9 Montpellier 1 et 2, Montpellier, France","Institut de pharmacologie mol\u00e9culaire et cellulaire"],"affiliations":[{"raw_affiliation_string":"1 Institut de Pharmacologie Mol\u00e9culaire et Cellulaire, CNRS UMR7275, Universit\u00e9 Nice \u2013 Sophia Antipolis, 660, route des lucioles 06560 Valbonne and 2Centre de Biochimie Structurale, INSERM U1054, CNRS UMR5048 \u2013 Universit\u00e9 Montpellier 1 et 2, Montpellier, France","institution_ids":["https://openalex.org/I4210160500","https://openalex.org/I154526488","https://openalex.org/I4210100279","https://openalex.org/I19894307","https://openalex.org/I1294671590"]},{"raw_affiliation_string":"Institut de pharmacologie mol\u00e9culaire et cellulaire","institution_ids":["https://openalex.org/I4210160500"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5050562187","display_name":"Lionel Colliandre","orcid":"https://orcid.org/0009-0006-1035-3696"},"institutions":[{"id":"https://openalex.org/I4210160500","display_name":"Institut de Pharmacologie Mol\u00e9culaire et Cellulaire","ror":"https://ror.org/05k4ema52","country_code":"FR","type":"facility","lineage":["https://openalex.org/I1294671590","https://openalex.org/I1294671590","https://openalex.org/I201841394","https://openalex.org/I4210096427","https://openalex.org/I4210160500"]},{"id":"https://openalex.org/I1294671590","display_name":"Centre National de la Recherche Scientifique","ror":"https://ror.org/02feahw73","country_code":"FR","type":"funder","lineage":["https://openalex.org/I1294671590"]},{"id":"https://openalex.org/I4210100279","display_name":"Centre de Biologie Structurale","ror":"https://ror.org/0189yvq06","country_code":"FR","type":"facility","lineage":["https://openalex.org/I1294671590","https://openalex.org/I154526488","https://openalex.org/I19894307","https://openalex.org/I4210100279"]},{"id":"https://openalex.org/I19894307","display_name":"Universit\u00e9 de Montpellier","ror":"https://ror.org/051escj72","country_code":"FR","type":"education","lineage":["https://openalex.org/I19894307"]},{"id":"https://openalex.org/I154526488","display_name":"Inserm","ror":"https://ror.org/02vjkv261","country_code":"FR","type":"funder","lineage":["https://openalex.org/I154526488"]}],"countries":["FR"],"is_corresponding":false,"raw_author_name":"Lionel Colliandre","raw_affiliation_strings":["1 Institut de Pharmacologie Mol\u00e9culaire et Cellulaire, CNRS UMR7275, Universit\u00e9 Nice \u2013 Sophia Antipolis, 660, route des lucioles 06560 Valbonne and 2Centre de Biochimie Structurale, INSERM U1054, CNRS UMR5048 \u2013 Universit\u00e9 Montpellier 1 et 2, Montpellier, France","Centre de Biochimie Structurale [Montpellier]"],"affiliations":[{"raw_affiliation_string":"1 Institut de Pharmacologie Mol\u00e9culaire et Cellulaire, CNRS UMR7275, Universit\u00e9 Nice \u2013 Sophia Antipolis, 660, route des lucioles 06560 Valbonne and 2Centre de Biochimie Structurale, INSERM U1054, CNRS UMR5048 \u2013 Universit\u00e9 Montpellier 1 et 2, Montpellier, France","institution_ids":["https://openalex.org/I4210160500","https://openalex.org/I154526488","https://openalex.org/I4210100279","https://openalex.org/I19894307","https://openalex.org/I1294671590"]},{"raw_affiliation_string":"Centre de Biochimie Structurale [Montpellier]","institution_ids":["https://openalex.org/I4210100279"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5046891747","display_name":"Jean\u2010Fran\u00e7ois Guichou","orcid":"https://orcid.org/0000-0002-7699-3235"},"institutions":[{"id":"https://openalex.org/I1294671590","display_name":"Centre National de la Recherche Scientifique","ror":"https://ror.org/02feahw73","country_code":"FR","type":"funder","lineage":["https://openalex.org/I1294671590"]},{"id":"https://openalex.org/I4210160500","display_name":"Institut de Pharmacologie Mol\u00e9culaire et Cellulaire","ror":"https://ror.org/05k4ema52","country_code":"FR","type":"facility","lineage":["https://openalex.org/I1294671590","https://openalex.org/I1294671590","https://openalex.org/I201841394","https://openalex.org/I4210096427","https://openalex.org/I4210160500"]},{"id":"https://openalex.org/I154526488","display_name":"Inserm","ror":"https://ror.org/02vjkv261","country_code":"FR","type":"funder","lineage":["https://openalex.org/I154526488"]},{"id":"https://openalex.org/I4210100279","display_name":"Centre de Biologie Structurale","ror":"https://ror.org/0189yvq06","country_code":"FR","type":"facility","lineage":["https://openalex.org/I1294671590","https://openalex.org/I154526488","https://openalex.org/I19894307","https://openalex.org/I4210100279"]},{"id":"https://openalex.org/I19894307","display_name":"Universit\u00e9 de Montpellier","ror":"https://ror.org/051escj72","country_code":"FR","type":"education","lineage":["https://openalex.org/I19894307"]}],"countries":["FR"],"is_corresponding":false,"raw_author_name":"Jean-Fran\u00e7ois Guichou","raw_affiliation_strings":["1 Institut de Pharmacologie Mol\u00e9culaire et Cellulaire, CNRS UMR7275, Universit\u00e9 Nice \u2013 Sophia Antipolis, 660, route des lucioles 06560 Valbonne and 2Centre de Biochimie Structurale, INSERM U1054, CNRS UMR5048 \u2013 Universit\u00e9 Montpellier 1 et 2, Montpellier, France","Centre de Biochimie Structurale [Montpellier]"],"affiliations":[{"raw_affiliation_string":"1 Institut de Pharmacologie Mol\u00e9culaire et Cellulaire, CNRS UMR7275, Universit\u00e9 Nice \u2013 Sophia Antipolis, 660, route des lucioles 06560 Valbonne and 2Centre de Biochimie Structurale, INSERM U1054, CNRS UMR5048 \u2013 Universit\u00e9 Montpellier 1 et 2, Montpellier, France","institution_ids":["https://openalex.org/I4210160500","https://openalex.org/I154526488","https://openalex.org/I4210100279","https://openalex.org/I19894307","https://openalex.org/I1294671590"]},{"raw_affiliation_string":"Centre de Biochimie Structurale [Montpellier]","institution_ids":["https://openalex.org/I4210100279"]}]},{"author_position":"last","author":{"id":"https://openalex.org/A5007296484","display_name":"Dominique Douguet","orcid":"https://orcid.org/0000-0001-6209-6464"},"institutions":[{"id":"https://openalex.org/I154526488","display_name":"Inserm","ror":"https://ror.org/02vjkv261","country_code":"FR","type":"funder","lineage":["https://openalex.org/I154526488"]},{"id":"https://openalex.org/I1294671590","display_name":"Centre National de la Recherche Scientifique","ror":"https://ror.org/02feahw73","country_code":"FR","type":"funder","lineage":["https://openalex.org/I1294671590"]},{"id":"https://openalex.org/I4210100279","display_name":"Centre de Biologie Structurale","ror":"https://ror.org/0189yvq06","country_code":"FR","type":"facility","lineage":["https://openalex.org/I1294671590","https://openalex.org/I154526488","https://openalex.org/I19894307","https://openalex.org/I4210100279"]},{"id":"https://openalex.org/I19894307","display_name":"Universit\u00e9 de Montpellier","ror":"https://ror.org/051escj72","country_code":"FR","type":"education","lineage":["https://openalex.org/I19894307"]},{"id":"https://openalex.org/I4210160500","display_name":"Institut de Pharmacologie Mol\u00e9culaire et Cellulaire","ror":"https://ror.org/05k4ema52","country_code":"FR","type":"facility","lineage":["https://openalex.org/I1294671590","https://openalex.org/I1294671590","https://openalex.org/I201841394","https://openalex.org/I4210096427","https://openalex.org/I4210160500"]}],"countries":["FR"],"is_corresponding":false,"raw_author_name":"Dominique Douguet","raw_affiliation_strings":["1 Institut de Pharmacologie Mol\u00e9culaire et Cellulaire, CNRS UMR7275, Universit\u00e9 Nice \u2013 Sophia Antipolis, 660, route des lucioles 06560 Valbonne and 2Centre de Biochimie Structurale, INSERM U1054, CNRS UMR5048 \u2013 Universit\u00e9 Montpellier 1 et 2, Montpellier, France","Institut de pharmacologie mol\u00e9culaire et cellulaire"],"affiliations":[{"raw_affiliation_string":"1 Institut de Pharmacologie Mol\u00e9culaire et Cellulaire, CNRS UMR7275, Universit\u00e9 Nice \u2013 Sophia Antipolis, 660, route des lucioles 06560 Valbonne and 2Centre de Biochimie Structurale, INSERM U1054, CNRS UMR5048 \u2013 Universit\u00e9 Montpellier 1 et 2, Montpellier, France","institution_ids":["https://openalex.org/I4210160500","https://openalex.org/I154526488","https://openalex.org/I4210100279","https://openalex.org/I19894307","https://openalex.org/I1294671590"]},{"raw_affiliation_string":"Institut de pharmacologie mol\u00e9culaire et cellulaire","institution_ids":["https://openalex.org/I4210160500"]}]}],"institutions":[],"countries_distinct_count":1,"institutions_distinct_count":4,"corresponding_author_ids":["https://openalex.org/A5044567900"],"corresponding_institution_ids":["https://openalex.org/I1294671590","https://openalex.org/I154526488","https://openalex.org/I19894307","https://openalex.org/I4210100279","https://openalex.org/I4210160500"],"apc_list":{"value":3618,"currency":"USD","value_usd":3618},"apc_paid":null,"fwci":6.6246,"has_fulltext":false,"cited_by_count":137,"citation_normalized_percentile":{"value":0.97321212,"is_in_top_1_percent":false,"is_in_top_10_percent":true},"cited_by_percentile_year":{"min":89,"max":100},"biblio":{"volume":"28","issue":"11","first_page":"1540","last_page":"1541"},"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/T10375","display_name":"Pharmacogenetics and Drug Metabolism","score":0.9951000213623047,"subfield":{"id":"https://openalex.org/subfields/3004","display_name":"Pharmacology"},"field":{"id":"https://openalex.org/fields/30","display_name":"Pharmacology, Toxicology and Pharmaceutics"},"domain":{"id":"https://openalex.org/domains/1","display_name":"Life Sciences"}},{"id":"https://openalex.org/T10252","display_name":"Microbial Natural Products and Biosynthesis","score":0.9919000267982483,"subfield":{"id":"https://openalex.org/subfields/2736","display_name":"Pharmacology"},"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/drug-repositioning","display_name":"Drug repositioning","score":0.7796156406402588},{"id":"https://openalex.org/keywords/in-silico","display_name":"In silico","score":0.6324100494384766},{"id":"https://openalex.org/keywords/fragment","display_name":"Fragment (logic)","score":0.6301518678665161},{"id":"https://openalex.org/keywords/computer-science","display_name":"Computer science","score":0.5983862280845642},{"id":"https://openalex.org/keywords/repurposing","display_name":"Repurposing","score":0.5862253904342651},{"id":"https://openalex.org/keywords/drug-discovery","display_name":"Drug discovery","score":0.5757030844688416},{"id":"https://openalex.org/keywords/drug","display_name":"Drug","score":0.5403627753257751},{"id":"https://openalex.org/keywords/computational-biology","display_name":"Computational biology","score":0.3476988971233368},{"id":"https://openalex.org/keywords/bioinformatics","display_name":"Bioinformatics","score":0.2071102261543274},{"id":"https://openalex.org/keywords/pharmacology","display_name":"Pharmacology","score":0.1793534755706787},{"id":"https://openalex.org/keywords/medicine","display_name":"Medicine","score":0.15213540196418762},{"id":"https://openalex.org/keywords/chemistry","display_name":"Chemistry","score":0.13892659544944763},{"id":"https://openalex.org/keywords/biology","display_name":"Biology","score":0.12026253342628479},{"id":"https://openalex.org/keywords/programming-language","display_name":"Programming language","score":0.061820149421691895}],"concepts":[{"id":"https://openalex.org/C103637391","wikidata":"https://www.wikidata.org/wiki/Q5308921","display_name":"Drug repositioning","level":3,"score":0.7796156406402588},{"id":"https://openalex.org/C2775905019","wikidata":"https://www.wikidata.org/wiki/Q192572","display_name":"In silico","level":3,"score":0.6324100494384766},{"id":"https://openalex.org/C2776235265","wikidata":"https://www.wikidata.org/wiki/Q18392052","display_name":"Fragment (logic)","level":2,"score":0.6301518678665161},{"id":"https://openalex.org/C41008148","wikidata":"https://www.wikidata.org/wiki/Q21198","display_name":"Computer science","level":0,"score":0.5983862280845642},{"id":"https://openalex.org/C519536355","wikidata":"https://www.wikidata.org/wiki/Q21021151","display_name":"Repurposing","level":2,"score":0.5862253904342651},{"id":"https://openalex.org/C74187038","wikidata":"https://www.wikidata.org/wiki/Q1418791","display_name":"Drug discovery","level":2,"score":0.5757030844688416},{"id":"https://openalex.org/C2780035454","wikidata":"https://www.wikidata.org/wiki/Q8386","display_name":"Drug","level":2,"score":0.5403627753257751},{"id":"https://openalex.org/C70721500","wikidata":"https://www.wikidata.org/wiki/Q177005","display_name":"Computational biology","level":1,"score":0.3476988971233368},{"id":"https://openalex.org/C60644358","wikidata":"https://www.wikidata.org/wiki/Q128570","display_name":"Bioinformatics","level":1,"score":0.2071102261543274},{"id":"https://openalex.org/C98274493","wikidata":"https://www.wikidata.org/wiki/Q128406","display_name":"Pharmacology","level":1,"score":0.1793534755706787},{"id":"https://openalex.org/C71924100","wikidata":"https://www.wikidata.org/wiki/Q11190","display_name":"Medicine","level":0,"score":0.15213540196418762},{"id":"https://openalex.org/C185592680","wikidata":"https://www.wikidata.org/wiki/Q2329","display_name":"Chemistry","level":0,"score":0.13892659544944763},{"id":"https://openalex.org/C86803240","wikidata":"https://www.wikidata.org/wiki/Q420","display_name":"Biology","level":0,"score":0.12026253342628479},{"id":"https://openalex.org/C199360897","wikidata":"https://www.wikidata.org/wiki/Q9143","display_name":"Programming language","level":1,"score":0.061820149421691895},{"id":"https://openalex.org/C18903297","wikidata":"https://www.wikidata.org/wiki/Q7150","display_name":"Ecology","level":1,"score":0.0},{"id":"https://openalex.org/C104317684","wikidata":"https://www.wikidata.org/wiki/Q7187","display_name":"Gene","level":2,"score":0.0},{"id":"https://openalex.org/C55493867","wikidata":"https://www.wikidata.org/wiki/Q7094","display_name":"Biochemistry","level":1,"score":0.0}],"mesh":[{"descriptor_ui":"D004364","descriptor_name":"Pharmaceutical Preparations","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":false},{"descriptor_ui":"D004364","descriptor_name":"Pharmaceutical Preparations","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":false},{"descriptor_ui":"D004364","descriptor_name":"Pharmaceutical Preparations","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":false},{"descriptor_ui":"D006801","descriptor_name":"Humans","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D006801","descriptor_name":"Humans","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D006801","descriptor_name":"Humans","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D008956","descriptor_name":"Models, Chemical","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D008956","descriptor_name":"Models, Chemical","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D008956","descriptor_name":"Models, Chemical","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D015195","descriptor_name":"Drug Design","qualifier_ui":null,"qualifier_name":null,"is_major_topic":true},{"descriptor_ui":"D015195","descriptor_name":"Drug Design","qualifier_ui":null,"qualifier_name":null,"is_major_topic":true},{"descriptor_ui":"D015195","descriptor_name":"Drug Design","qualifier_ui":null,"qualifier_name":null,"is_major_topic":true},{"descriptor_ui":"D016208","descriptor_name":"Databases, Factual","qualifier_ui":null,"qualifier_name":null,"is_major_topic":true},{"descriptor_ui":"D016208","descriptor_name":"Databases, Factual","qualifier_ui":null,"qualifier_name":null,"is_major_topic":true},{"descriptor_ui":"D016208","descriptor_name":"Databases, Factual","qualifier_ui":null,"qualifier_name":null,"is_major_topic":true},{"descriptor_ui":"D020407","descriptor_name":"Internet","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D020407","descriptor_name":"Internet","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D020407","descriptor_name":"Internet","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D021983","descriptor_name":"Cyclophilins","qualifier_ui":"Q000037","qualifier_name":"antagonists & inhibitors","is_major_topic":false},{"descriptor_ui":"D021983","descriptor_name":"Cyclophilins","qualifier_ui":"Q000037","qualifier_name":"antagonists & inhibitors","is_major_topic":false},{"descriptor_ui":"D021983","descriptor_name":"Cyclophilins","qualifier_ui":"Q000037","qualifier_name":"antagonists & inhibitors","is_major_topic":false},{"descriptor_ui":"D055808","descriptor_name":"Drug Discovery","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D055808","descriptor_name":"Drug Discovery","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D055808","descriptor_name":"Drug Discovery","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D058492","descriptor_name":"Drug Repositioning","qualifier_ui":null,"qualifier_name":null,"is_major_topic":true},{"descriptor_ui":"D058492","descriptor_name":"Drug Repositioning","qualifier_ui":null,"qualifier_name":null,"is_major_topic":true},{"descriptor_ui":"D058492","descriptor_name":"Drug Repositioning","qualifier_ui":null,"qualifier_name":null,"is_major_topic":true}],"locations_count":3,"locations":[{"id":"doi:10.1093/bioinformatics/bts186","is_oa":true,"landing_page_url":"https://doi.org/10.1093/bioinformatics/bts186","pdf_url":"https://academic.oup.com/bioinformatics/article-pdf/28/11/1540/48868517/bioinformatics_28_11_1540.pdf","source":{"id":"https://openalex.org/S52395412","display_name":"Bioinformatics","issn_l":"1367-4803","issn":["1367-4803","1367-4811"],"is_oa":false,"is_in_doaj":true,"is_core":true,"host_organization":"https://openalex.org/P4310311648","host_organization_name":"Oxford University Press","host_organization_lineage":["https://openalex.org/P4310311648","https://openalex.org/P4310311647"],"host_organization_lineage_names":["Oxford University Press","University of Oxford"],"type":"journal"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Bioinformatics","raw_type":"journal-article"},{"id":"pmid:22539672","is_oa":false,"landing_page_url":"https://pubmed.ncbi.nlm.nih.gov/22539672","pdf_url":null,"source":{"id":"https://openalex.org/S4306525036","display_name":"PubMed","issn_l":null,"issn":null,"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":[],"type":"repository"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Bioinformatics (Oxford, England)","raw_type":null},{"id":"pmh:oai:HAL:hal-02115767v1","is_oa":false,"landing_page_url":"https://hal.science/hal-02115767","pdf_url":null,"source":{"id":"https://openalex.org/S4306402512","display_name":"HAL (Le Centre pour la Communication Scientifique Directe)","issn_l":null,"issn":null,"is_oa":false,"is_in_doaj":false,"is_core":false,"host_organization":"https://openalex.org/I1294671590","host_organization_name":"Centre National de la Recherche Scientifique","host_organization_lineage":["https://openalex.org/I1294671590"],"host_organization_lineage_names":[],"type":"repository"},"license":null,"license_id":null,"version":"submittedVersion","is_accepted":false,"is_published":false,"raw_source_name":"Bioinformatics, 2012, 28 (11), pp.1540-1541. ⟨10.1093/bioinformatics/bts186⟩","raw_type":"Journal articles"}],"best_oa_location":{"id":"doi:10.1093/bioinformatics/bts186","is_oa":true,"landing_page_url":"https://doi.org/10.1093/bioinformatics/bts186","pdf_url":"https://academic.oup.com/bioinformatics/article-pdf/28/11/1540/48868517/bioinformatics_28_11_1540.pdf","source":{"id":"https://openalex.org/S52395412","display_name":"Bioinformatics","issn_l":"1367-4803","issn":["1367-4803","1367-4811"],"is_oa":false,"is_in_doaj":true,"is_core":true,"host_organization":"https://openalex.org/P4310311648","host_organization_name":"Oxford University Press","host_organization_lineage":["https://openalex.org/P4310311648","https://openalex.org/P4310311647"],"host_organization_lineage_names":["Oxford University Press","University of Oxford"],"type":"journal"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Bioinformatics","raw_type":"journal-article"},"sustainable_development_goals":[],"awards":[],"funders":[],"has_content":{"grobid_xml":true,"pdf":true},"content_urls":{"pdf":"https://content.openalex.org/works/W2162723974.pdf","grobid_xml":"https://content.openalex.org/works/W2162723974.grobid-xml"},"referenced_works_count":17,"referenced_works":["https://openalex.org/W1586980098","https://openalex.org/W1987932628","https://openalex.org/W1996100382","https://openalex.org/W2006720282","https://openalex.org/W2047534469","https://openalex.org/W2053127979","https://openalex.org/W2076664894","https://openalex.org/W2083422277","https://openalex.org/W2096541451","https://openalex.org/W2098767742","https://openalex.org/W2133447437","https://openalex.org/W2134503191","https://openalex.org/W2137052779","https://openalex.org/W2154896031","https://openalex.org/W2155721378","https://openalex.org/W2278631926","https://openalex.org/W6694818005"],"related_works":["https://openalex.org/W2899096130","https://openalex.org/W3190782215","https://openalex.org/W2902729297","https://openalex.org/W3110500039","https://openalex.org/W4255531208","https://openalex.org/W4396858017","https://openalex.org/W4206422705","https://openalex.org/W4320009247","https://openalex.org/W4226161264","https://openalex.org/W3186872001"],"abstract_inverted_index":{"e-Drug3D":[0],"collections":[1],"are":[2],"freely":[3],"available":[4],"at":[5],"http://chemoinfo.ipmc.cnrs.fr/e-drug3d.html":[6],"either":[7],"for":[8,11],"download":[9],"or":[10],"direct":[12],"in":[13],"silico":[14],"web-based":[15],"screenings.":[16]},"counts_by_year":[{"year":2026,"cited_by_count":5},{"year":2025,"cited_by_count":11},{"year":2024,"cited_by_count":12},{"year":2023,"cited_by_count":12},{"year":2022,"cited_by_count":11},{"year":2021,"cited_by_count":7},{"year":2020,"cited_by_count":14},{"year":2019,"cited_by_count":12},{"year":2018,"cited_by_count":14},{"year":2017,"cited_by_count":12},{"year":2016,"cited_by_count":7},{"year":2015,"cited_by_count":12},{"year":2014,"cited_by_count":1},{"year":2013,"cited_by_count":5},{"year":2012,"cited_by_count":1}],"updated_date":"2026-03-28T08:17:26.163206","created_date":"2025-10-10T00:00:00"}