{"id":"https://openalex.org/W2071999497","doi":"https://doi.org/10.1021/ci4003014","title":"Insights into AT<sub>1</sub> Receptor Activation through AngII Binding Studies","display_name":"Insights into AT<sub>1</sub> Receptor Activation through AngII Binding Studies","publication_year":2013,"publication_date":"2013-09-21","ids":{"openalex":"https://openalex.org/W2071999497","doi":"https://doi.org/10.1021/ci4003014","mag":"2071999497"},"language":"en","primary_location":{"id":"doi:10.1021/ci4003014","is_oa":false,"landing_page_url":"https://doi.org/10.1021/ci4003014","pdf_url":null,"source":{"id":"https://openalex.org/S167262187","display_name":"Journal of Chemical Information and Modeling","issn_l":"1549-9596","issn":["1549-9596","1549-960X"],"is_oa":false,"is_in_doaj":false,"is_core":true,"host_organization":"https://openalex.org/P4310320006","host_organization_name":"American Chemical Society","host_organization_lineage":["https://openalex.org/P4310320006"],"host_organization_lineage_names":["American Chemical Society"],"type":"journal"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Journal of Chemical Information and Modeling","raw_type":"journal-article"},"type":"article","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/A5066738950","display_name":"Minos\u2013Timotheos Matsoukas","orcid":"https://orcid.org/0000-0002-4642-8163"},"institutions":[{"id":"https://openalex.org/I123044942","display_name":"Universitat Aut\u00f2noma de Barcelona","ror":"https://ror.org/052g8jq94","country_code":"ES","type":"education","lineage":["https://openalex.org/I123044942"]}],"countries":["ES"],"is_corresponding":true,"raw_author_name":"Minos-Timotheos Matsoukas","raw_affiliation_strings":["Laboratori\rde Medicina Computacional, Unitat de Bioestad\u0131stica, Facultat\rde Medicina, Universitat Autonoma de Barcelona, E-08193, Bellaterra, Barcelona, Spain"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Laboratori\rde Medicina Computacional, Unitat de Bioestad\u0131stica, Facultat\rde Medicina, Universitat Autonoma de Barcelona, E-08193, Bellaterra, Barcelona, Spain","institution_ids":["https://openalex.org/I123044942"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5027815553","display_name":"Constantinos Potamitis","orcid":"https://orcid.org/0000-0002-8830-7677"},"institutions":[{"id":"https://openalex.org/I4210127711","display_name":"National Hellenic Research Foundation","ror":"https://ror.org/033m02g29","country_code":"GR","type":"funder","lineage":["https://openalex.org/I4210127711"]}],"countries":["GR"],"is_corresponding":false,"raw_author_name":"Constantinos Potamitis","raw_affiliation_strings":["Institute\rof Biology, Medicinal Chemistry and Biotechnology, National Hellenic Research Foundation, 48, Vas. Constantinou Avenue, GR-11635, Athens, Greece","Institute#R#of Biology, Medicinal Chemistry and Biotechnology, National Hellenic Research Foundation, 48, Vas. Constantinou Avenue, GR-11635, Athens, Greece"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Institute\rof Biology, Medicinal Chemistry and Biotechnology, National Hellenic Research Foundation, 48, Vas. Constantinou Avenue, GR-11635, Athens, Greece","institution_ids":["https://openalex.org/I4210127711"]},{"raw_affiliation_string":"Institute#R#of Biology, Medicinal Chemistry and Biotechnology, National Hellenic Research Foundation, 48, Vas. Constantinou Avenue, GR-11635, Athens, Greece","institution_ids":["https://openalex.org/I4210127711"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5013670963","display_name":"Panayiotis Plotas","orcid":null},"institutions":[{"id":"https://openalex.org/I174878644","display_name":"University of Patras","ror":"https://ror.org/017wvtq80","country_code":"GR","type":"education","lineage":["https://openalex.org/I174878644"]}],"countries":["GR"],"is_corresponding":false,"raw_author_name":"Panayiotis Plotas","raw_affiliation_strings":["Laboratory\rof Organic Chemistry, Biochemistry and Natural Products, Department\rof Chemistry, University of Patras, GR-26500, Rion, Patras, Greece","Laboratory#R#of Organic Chemistry, Biochemistry and Natural Products, Department#R#of Chemistry, University of Patras, GR-26500, Rion, Patras, Greece"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Laboratory\rof Organic Chemistry, Biochemistry and Natural Products, Department\rof Chemistry, University of Patras, GR-26500, Rion, Patras, Greece","institution_ids":["https://openalex.org/I174878644"]},{"raw_affiliation_string":"Laboratory#R#of Organic Chemistry, Biochemistry and Natural Products, Department#R#of Chemistry, University of Patras, GR-26500, Rion, Patras, Greece","institution_ids":["https://openalex.org/I174878644"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5051713342","display_name":"Maria\u2010Eleni Androutsou","orcid":null},"institutions":[{"id":"https://openalex.org/I174878644","display_name":"University of Patras","ror":"https://ror.org/017wvtq80","country_code":"GR","type":"education","lineage":["https://openalex.org/I174878644"]}],"countries":["GR"],"is_corresponding":false,"raw_author_name":"Maria-Eleni Androutsou","raw_affiliation_strings":["Laboratory\rof Organic Chemistry, Biochemistry and Natural Products, Department\rof Chemistry, University of Patras, GR-26500, Rion, Patras, Greece","Laboratory#R#of Organic Chemistry, Biochemistry and Natural Products, Department#R#of Chemistry, University of Patras, GR-26500, Rion, Patras, Greece"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Laboratory\rof Organic Chemistry, Biochemistry and Natural Products, Department\rof Chemistry, University of Patras, GR-26500, Rion, Patras, Greece","institution_ids":["https://openalex.org/I174878644"]},{"raw_affiliation_string":"Laboratory#R#of Organic Chemistry, Biochemistry and Natural Products, Department#R#of Chemistry, University of Patras, GR-26500, Rion, Patras, Greece","institution_ids":["https://openalex.org/I174878644"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5111575557","display_name":"George Agelis","orcid":null},"institutions":[{"id":"https://openalex.org/I174878644","display_name":"University of Patras","ror":"https://ror.org/017wvtq80","country_code":"GR","type":"education","lineage":["https://openalex.org/I174878644"]}],"countries":["GR"],"is_corresponding":false,"raw_author_name":"George Agelis","raw_affiliation_strings":["Laboratory\rof Organic Chemistry, Biochemistry and Natural Products, Department\rof Chemistry, University of Patras, GR-26500, Rion, Patras, Greece","Laboratory#R#of Organic Chemistry, Biochemistry and Natural Products, Department#R#of Chemistry, University of Patras, GR-26500, Rion, Patras, Greece"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Laboratory\rof Organic Chemistry, Biochemistry and Natural Products, Department\rof Chemistry, University of Patras, GR-26500, Rion, Patras, Greece","institution_ids":["https://openalex.org/I174878644"]},{"raw_affiliation_string":"Laboratory#R#of Organic Chemistry, Biochemistry and Natural Products, Department#R#of Chemistry, University of Patras, GR-26500, Rion, Patras, Greece","institution_ids":["https://openalex.org/I174878644"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5072960254","display_name":"John Matsoukas","orcid":"https://orcid.org/0000-0001-5554-2964"},"institutions":[{"id":"https://openalex.org/I174878644","display_name":"University of Patras","ror":"https://ror.org/017wvtq80","country_code":"GR","type":"education","lineage":["https://openalex.org/I174878644"]}],"countries":["GR"],"is_corresponding":false,"raw_author_name":"John Matsoukas","raw_affiliation_strings":["Laboratory\rof Organic Chemistry, Biochemistry and Natural Products, Department\rof Chemistry, University of Patras, GR-26500, Rion, Patras, Greece","Laboratory#R#of Organic Chemistry, Biochemistry and Natural Products, Department#R#of Chemistry, University of Patras, GR-26500, Rion, Patras, Greece"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Laboratory\rof Organic Chemistry, Biochemistry and Natural Products, Department\rof Chemistry, University of Patras, GR-26500, Rion, Patras, Greece","institution_ids":["https://openalex.org/I174878644"]},{"raw_affiliation_string":"Laboratory#R#of Organic Chemistry, Biochemistry and Natural Products, Department#R#of Chemistry, University of Patras, GR-26500, Rion, Patras, Greece","institution_ids":["https://openalex.org/I174878644"]}]},{"author_position":"last","author":{"id":"https://openalex.org/A5004837739","display_name":"Panagiotis Zoumpoulakis","orcid":"https://orcid.org/0000-0001-9348-6078"},"institutions":[{"id":"https://openalex.org/I4210127711","display_name":"National Hellenic Research Foundation","ror":"https://ror.org/033m02g29","country_code":"GR","type":"funder","lineage":["https://openalex.org/I4210127711"]}],"countries":["GR"],"is_corresponding":false,"raw_author_name":"Panagiotis Zoumpoulakis","raw_affiliation_strings":["Institute\rof Biology, Medicinal Chemistry and Biotechnology, National Hellenic Research Foundation, 48, Vas. Constantinou Avenue, GR-11635, Athens, Greece","Institute#R#of Biology, Medicinal Chemistry and Biotechnology, National Hellenic Research Foundation, 48, Vas. Constantinou Avenue, GR-11635, Athens, Greece"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Institute\rof Biology, Medicinal Chemistry and Biotechnology, National Hellenic Research Foundation, 48, Vas. Constantinou Avenue, GR-11635, Athens, Greece","institution_ids":["https://openalex.org/I4210127711"]},{"raw_affiliation_string":"Institute#R#of Biology, Medicinal Chemistry and Biotechnology, National Hellenic Research Foundation, 48, Vas. Constantinou Avenue, GR-11635, Athens, Greece","institution_ids":["https://openalex.org/I4210127711"]}]}],"institutions":[],"countries_distinct_count":2,"institutions_distinct_count":7,"corresponding_author_ids":["https://openalex.org/A5066738950"],"corresponding_institution_ids":["https://openalex.org/I123044942"],"apc_list":null,"apc_paid":null,"fwci":1.3462,"has_fulltext":false,"cited_by_count":29,"citation_normalized_percentile":{"value":0.8036576,"is_in_top_1_percent":false,"is_in_top_10_percent":false},"cited_by_percentile_year":{"min":90,"max":99},"biblio":{"volume":"53","issue":"11","first_page":"2798","last_page":"2811"},"is_retracted":false,"is_paratext":false,"is_xpac":false,"primary_topic":{"id":"https://openalex.org/T11178","display_name":"Receptor Mechanisms and Signaling","score":1.0,"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"}},"topics":[{"id":"https://openalex.org/T11178","display_name":"Receptor Mechanisms and Signaling","score":1.0,"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/T10211","display_name":"Computational Drug Discovery Methods","score":0.9947999715805054,"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/T10044","display_name":"Protein Structure and Dynamics","score":0.9941999912261963,"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/angiotensin-ii","display_name":"Angiotensin II","score":0.8035063147544861},{"id":"https://openalex.org/keywords/in-silico","display_name":"In silico","score":0.7782003879547119},{"id":"https://openalex.org/keywords/g-protein-coupled-receptor","display_name":"G protein-coupled receptor","score":0.692142903804779},{"id":"https://openalex.org/keywords/receptor","display_name":"Receptor","score":0.6317620277404785},{"id":"https://openalex.org/keywords/agonist","display_name":"Agonist","score":0.6310029029846191},{"id":"https://openalex.org/keywords/chemistry","display_name":"Chemistry","score":0.5600641965866089},{"id":"https://openalex.org/keywords/docking","display_name":"Docking (animal)","score":0.48401567339897156},{"id":"https://openalex.org/keywords/peptide","display_name":"Peptide","score":0.4451587498188019},{"id":"https://openalex.org/keywords/angiotensin-receptor","display_name":"Angiotensin receptor","score":0.4252047538757324},{"id":"https://openalex.org/keywords/biophysics","display_name":"Biophysics","score":0.3585193157196045},{"id":"https://openalex.org/keywords/computational-biology","display_name":"Computational biology","score":0.3324962258338928},{"id":"https://openalex.org/keywords/biochemistry","display_name":"Biochemistry","score":0.28680771589279175},{"id":"https://openalex.org/keywords/biology","display_name":"Biology","score":0.2813832461833954},{"id":"https://openalex.org/keywords/medicine","display_name":"Medicine","score":0.09810402989387512}],"concepts":[{"id":"https://openalex.org/C2908929049","wikidata":"https://www.wikidata.org/wiki/Q65963433","display_name":"Angiotensin II","level":3,"score":0.8035063147544861},{"id":"https://openalex.org/C2775905019","wikidata":"https://www.wikidata.org/wiki/Q192572","display_name":"In silico","level":3,"score":0.7782003879547119},{"id":"https://openalex.org/C135285700","wikidata":"https://www.wikidata.org/wiki/Q38173","display_name":"G protein-coupled receptor","level":3,"score":0.692142903804779},{"id":"https://openalex.org/C170493617","wikidata":"https://www.wikidata.org/wiki/Q208467","display_name":"Receptor","level":2,"score":0.6317620277404785},{"id":"https://openalex.org/C2778938600","wikidata":"https://www.wikidata.org/wiki/Q389934","display_name":"Agonist","level":3,"score":0.6310029029846191},{"id":"https://openalex.org/C185592680","wikidata":"https://www.wikidata.org/wiki/Q2329","display_name":"Chemistry","level":0,"score":0.5600641965866089},{"id":"https://openalex.org/C41685203","wikidata":"https://www.wikidata.org/wiki/Q1974042","display_name":"Docking (animal)","level":2,"score":0.48401567339897156},{"id":"https://openalex.org/C2779281246","wikidata":"https://www.wikidata.org/wiki/Q172847","display_name":"Peptide","level":2,"score":0.4451587498188019},{"id":"https://openalex.org/C104849204","wikidata":"https://www.wikidata.org/wiki/Q24778533","display_name":"Angiotensin receptor","level":4,"score":0.4252047538757324},{"id":"https://openalex.org/C12554922","wikidata":"https://www.wikidata.org/wiki/Q7100","display_name":"Biophysics","level":1,"score":0.3585193157196045},{"id":"https://openalex.org/C70721500","wikidata":"https://www.wikidata.org/wiki/Q177005","display_name":"Computational biology","level":1,"score":0.3324962258338928},{"id":"https://openalex.org/C55493867","wikidata":"https://www.wikidata.org/wiki/Q7094","display_name":"Biochemistry","level":1,"score":0.28680771589279175},{"id":"https://openalex.org/C86803240","wikidata":"https://www.wikidata.org/wiki/Q420","display_name":"Biology","level":0,"score":0.2813832461833954},{"id":"https://openalex.org/C71924100","wikidata":"https://www.wikidata.org/wiki/Q11190","display_name":"Medicine","level":0,"score":0.09810402989387512},{"id":"https://openalex.org/C104317684","wikidata":"https://www.wikidata.org/wiki/Q7187","display_name":"Gene","level":2,"score":0.0},{"id":"https://openalex.org/C159110408","wikidata":"https://www.wikidata.org/wiki/Q121176","display_name":"Nursing","level":1,"score":0.0}],"mesh":[],"locations_count":2,"locations":[{"id":"doi:10.1021/ci4003014","is_oa":false,"landing_page_url":"https://doi.org/10.1021/ci4003014","pdf_url":null,"source":{"id":"https://openalex.org/S167262187","display_name":"Journal of Chemical Information and Modeling","issn_l":"1549-9596","issn":["1549-9596","1549-960X"],"is_oa":false,"is_in_doaj":false,"is_core":true,"host_organization":"https://openalex.org/P4310320006","host_organization_name":"American Chemical Society","host_organization_lineage":["https://openalex.org/P4310320006"],"host_organization_lineage_names":["American Chemical Society"],"type":"journal"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Journal of Chemical Information and Modeling","raw_type":"journal-article"},{"id":"mag:24053563","is_oa":false,"landing_page_url":"https://dialnet.unirioja.es/servlet/articulo?codigo=1073314","pdf_url":null,"source":{"id":"https://openalex.org/S4306401293","display_name":"Dialnet (Universidad de la Rioja)","issn_l":null,"issn":null,"is_oa":false,"is_in_doaj":false,"is_core":false,"host_organization":"https://openalex.org/I3032752892","host_organization_name":"Universidad Internacional de La Rioja","host_organization_lineage":["https://openalex.org/I3032752892"],"host_organization_lineage_names":[],"type":"repository"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Chemical engineering","raw_type":null}],"best_oa_location":null,"sustainable_development_goals":[],"awards":[],"funders":[],"has_content":{"grobid_xml":false,"pdf":false},"content_urls":null,"referenced_works_count":62,"referenced_works":["https://openalex.org/W45361943","https://openalex.org/W70782241","https://openalex.org/W1487725726","https://openalex.org/W1777056623","https://openalex.org/W1825353903","https://openalex.org/W1963574759","https://openalex.org/W1979670456","https://openalex.org/W1979728801","https://openalex.org/W1980374511","https://openalex.org/W1980962873","https://openalex.org/W1981021420","https://openalex.org/W1984132657","https://openalex.org/W1984780557","https://openalex.org/W1986191025","https://openalex.org/W1987039100","https://openalex.org/W1995183079","https://openalex.org/W1999613945","https://openalex.org/W2008035364","https://openalex.org/W2009376892","https://openalex.org/W2010565830","https://openalex.org/W2014541413","https://openalex.org/W2020181303","https://openalex.org/W2021565138","https://openalex.org/W2029011149","https://openalex.org/W2031150814","https://openalex.org/W2040830107","https://openalex.org/W2041344314","https://openalex.org/W2050507620","https://openalex.org/W2053963685","https://openalex.org/W2062119305","https://openalex.org/W2063844010","https://openalex.org/W2067174909","https://openalex.org/W2067224374","https://openalex.org/W2073791145","https://openalex.org/W2073824216","https://openalex.org/W2077919926","https://openalex.org/W2081260116","https://openalex.org/W2085560961","https://openalex.org/W2087702258","https://openalex.org/W2093628219","https://openalex.org/W2103908315","https://openalex.org/W2103945336","https://openalex.org/W2109014958","https://openalex.org/W2121362961","https://openalex.org/W2129508497","https://openalex.org/W2135020482","https://openalex.org/W2140820106","https://openalex.org/W2146783323","https://openalex.org/W2152853006","https://openalex.org/W2155777324","https://openalex.org/W2161605421","https://openalex.org/W2162109316","https://openalex.org/W2167857702","https://openalex.org/W2168725185","https://openalex.org/W2168782248","https://openalex.org/W2321951077","https://openalex.org/W2323072331","https://openalex.org/W2483716480","https://openalex.org/W2519703809","https://openalex.org/W2883755802","https://openalex.org/W4230526395","https://openalex.org/W4233334497"],"related_works":["https://openalex.org/W1979013132","https://openalex.org/W2123563726","https://openalex.org/W3164503237","https://openalex.org/W2117895782","https://openalex.org/W2048842720","https://openalex.org/W2099019879","https://openalex.org/W2104265414","https://openalex.org/W2071999497","https://openalex.org/W2160515417","https://openalex.org/W4224217486"],"abstract_inverted_index":{"This":[0],"study":[1,117],"investigates":[2],"the":[3,10,36,69,75,88,101,106,110,115,126,131,136,139],"binding":[4,121],"of":[5,39,80,97,103,109,123,135],"angiotensin":[6,11],"II":[7,12],"(AngII)":[8],"to":[9,34,67,87,125],"type":[13],"1":[14],"receptor":[15,111,137],"(AT1R),":[16],"taking":[17],"into":[18],"consideration":[19],"several":[20,43],"known":[21,77],"activation":[22,71,143],"elements":[23,134],"that":[24],"have":[25],"been":[26],"observed":[27],"for":[28],"G-protein-coupled":[29],"receptors":[30],"(GPCRs).":[31],"In":[32],"order":[33],"determine":[35],"crucial":[37],"interactions":[38],"AngII":[40,49,91,104,124],"upon":[41,82,142],"binding,":[42],"MD":[44,85],"simulations":[45,86],"were":[46,112],"implemented":[47],"using":[48],"conformations":[50],"derived":[51],"from":[52],"experimental":[53],"data":[54],"(NMR":[55],"ROEs)":[56],"and":[57,73,105,138,146],"in":[58,100,147],"silico":[59,148],"flexible":[60],"docking":[61],"methodologies.":[62],"An":[63],"additional":[64],"goal":[65],"was":[66],"simulate":[68],"induced":[70],"mechanism":[72],"examine":[74],"already":[76],"structural":[78],"rearrangements":[79],"GPCRs":[81],"activation.":[83],"Performing":[84],"AT1R":[89],"\u2013":[90,92],"lipids":[93],"complex,":[94],"a":[95,119],"series":[96],"dynamic":[98],"changes":[99],"topology":[102],"intracellular":[107],"part":[108],"observed.":[113],"Overall,":[114],"present":[116],"proposes":[118],"complete":[120],"profile":[122],"AT1R,":[127],"as":[128,130],"well":[129],"key":[132],"transitional":[133],"agonist":[140],"peptide":[141],"through":[144],"NMR":[145],"studies.":[149]},"counts_by_year":[{"year":2024,"cited_by_count":1},{"year":2023,"cited_by_count":1},{"year":2022,"cited_by_count":3},{"year":2021,"cited_by_count":2},{"year":2020,"cited_by_count":2},{"year":2019,"cited_by_count":6},{"year":2018,"cited_by_count":3},{"year":2017,"cited_by_count":2},{"year":2016,"cited_by_count":4},{"year":2015,"cited_by_count":4},{"year":2014,"cited_by_count":1}],"updated_date":"2026-05-05T08:41:31.759640","created_date":"2016-06-24T00:00:00"}