{"id":"https://openalex.org/W2073025354","doi":"https://doi.org/10.1371/journal.pcbi.1002532","title":"General Anesthetics Predicted to Block the GLIC Pore with Micromolar Affinity","display_name":"General Anesthetics Predicted to Block the GLIC Pore with Micromolar Affinity","publication_year":2012,"publication_date":"2012-05-31","ids":{"openalex":"https://openalex.org/W2073025354","doi":"https://doi.org/10.1371/journal.pcbi.1002532","mag":"2073025354","pmid":"https://pubmed.ncbi.nlm.nih.gov/22693438"},"language":"en","primary_location":{"id":"doi:10.1371/journal.pcbi.1002532","is_oa":true,"landing_page_url":"https://doi.org/10.1371/journal.pcbi.1002532","pdf_url":"https://journals.plos.org/ploscompbiol/article/file?id=10.1371/journal.pcbi.1002532&type=printable","source":{"id":"https://openalex.org/S86033158","display_name":"PLoS Computational Biology","issn_l":"1553-734X","issn":["1553-734X","1553-7358"],"is_oa":true,"is_in_doaj":true,"is_core":true,"host_organization":"https://openalex.org/P4310315706","host_organization_name":"Public Library of Science","host_organization_lineage":["https://openalex.org/P4310315706"],"host_organization_lineage_names":["Public Library of Science"],"type":"journal"},"license":"cc-by","license_id":"https://openalex.org/licenses/cc-by","version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"PLoS Computational Biology","raw_type":"journal-article"},"type":"article","indexed_in":["crossref","doaj","pubmed"],"open_access":{"is_oa":true,"oa_status":"gold","oa_url":"https://journals.plos.org/ploscompbiol/article/file?id=10.1371/journal.pcbi.1002532&type=printable","any_repository_has_fulltext":true},"authorships":[{"author_position":"first","author":{"id":"https://openalex.org/A5040785755","display_name":"David N. LeBard","orcid":"https://orcid.org/0000-0002-0979-800X"},"institutions":[{"id":"https://openalex.org/I84392919","display_name":"Temple University","ror":"https://ror.org/00kx1jb78","country_code":"US","type":"education","lineage":["https://openalex.org/I84392919"]}],"countries":["US"],"is_corresponding":false,"raw_author_name":"David N. LeBard","raw_affiliation_strings":["Department of Chemistry and Institute for Computational Molecular Science, Temple University, Philadelphia, Pennsylvania, United States of America"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Chemistry and Institute for Computational Molecular Science, Temple University, Philadelphia, Pennsylvania, United States of America","institution_ids":["https://openalex.org/I84392919"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5016364652","display_name":"J\u00e9r\u00f4me H\u00e9nin","orcid":"https://orcid.org/0000-0003-2540-4098"},"institutions":[{"id":"https://openalex.org/I4210146787","display_name":"Architecture et Fonction des Macromol\u00e9cules Biologiques","ror":"https://ror.org/04jm8zw14","country_code":"FR","type":"facility","lineage":["https://openalex.org/I1294671590","https://openalex.org/I1294671590","https://openalex.org/I21491767","https://openalex.org/I4210088668","https://openalex.org/I4210096427","https://openalex.org/I4210146787"]},{"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/I21491767","display_name":"Aix-Marseille Universit\u00e9","ror":"https://ror.org/035xkbk20","country_code":"FR","type":"education","lineage":["https://openalex.org/I21491767"]}],"countries":["FR"],"is_corresponding":false,"raw_author_name":"J\u00e9r\u00f4me H\u00e9nin","raw_affiliation_strings":["Laboratoire d'Ing\u00e9nierie des Structures Macromol\u00e9culaires, CNRS and Aix-Marseille University, Marseille, France"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Laboratoire d'Ing\u00e9nierie des Structures Macromol\u00e9culaires, CNRS and Aix-Marseille University, Marseille, France","institution_ids":["https://openalex.org/I4210146787","https://openalex.org/I21491767","https://openalex.org/I1294671590"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5007410972","display_name":"Roderic G. Eckenhoff","orcid":"https://orcid.org/0000-0002-5581-746X"},"institutions":[{"id":"https://openalex.org/I79576946","display_name":"University of Pennsylvania","ror":"https://ror.org/00b30xv10","country_code":"US","type":"education","lineage":["https://openalex.org/I79576946"]}],"countries":["US"],"is_corresponding":false,"raw_author_name":"Roderic G. Eckenhoff","raw_affiliation_strings":["Department of Anesthesiology and Critical Care, University of Pennsylvania School of Medicine, Philadelphia, Pennsylvania, United States of America"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Anesthesiology and Critical Care, University of Pennsylvania School of Medicine, Philadelphia, Pennsylvania, United States of America","institution_ids":["https://openalex.org/I79576946"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5068247471","display_name":"Michael L. Klein","orcid":"https://orcid.org/0000-0002-0027-9262"},"institutions":[{"id":"https://openalex.org/I84392919","display_name":"Temple University","ror":"https://ror.org/00kx1jb78","country_code":"US","type":"education","lineage":["https://openalex.org/I84392919"]}],"countries":["US"],"is_corresponding":false,"raw_author_name":"Michael L. Klein","raw_affiliation_strings":["Department of Chemistry and Institute for Computational Molecular Science, Temple University, Philadelphia, Pennsylvania, United States of America"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Chemistry and Institute for Computational Molecular Science, Temple University, Philadelphia, Pennsylvania, United States of America","institution_ids":["https://openalex.org/I84392919"]}]},{"author_position":"last","author":{"id":"https://openalex.org/A5017245953","display_name":"Grace Brannigan","orcid":"https://orcid.org/0000-0001-8949-2694"},"institutions":[{"id":"https://openalex.org/I102322142","display_name":"Rutgers, The State University of New Jersey","ror":"https://ror.org/05vt9qd57","country_code":"US","type":"education","lineage":["https://openalex.org/I102322142"]}],"countries":["US"],"is_corresponding":true,"raw_author_name":"Grace Brannigan","raw_affiliation_strings":["Department of Physics and Center for Computational and Integrative Biology, Rutgers University-Camden, Camden, New Jersey, United States of America"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Physics and Center for Computational and Integrative Biology, Rutgers University-Camden, Camden, New Jersey, United States of America","institution_ids":["https://openalex.org/I102322142"]}]}],"institutions":[],"countries_distinct_count":2,"institutions_distinct_count":5,"corresponding_author_ids":["https://openalex.org/A5017245953"],"corresponding_institution_ids":["https://openalex.org/I102322142"],"apc_list":{"value":2655,"currency":"USD","value_usd":2655},"apc_paid":{"value":2655,"currency":"USD","value_usd":2655},"fwci":2.9561,"has_fulltext":true,"cited_by_count":63,"citation_normalized_percentile":{"value":0.91692766,"is_in_top_1_percent":false,"is_in_top_10_percent":true},"cited_by_percentile_year":{"min":90,"max":99},"biblio":{"volume":"8","issue":"5","first_page":"e1002532","last_page":"e1002532"},"is_retracted":false,"is_paratext":false,"is_xpac":false,"primary_topic":{"id":"https://openalex.org/T10493","display_name":"Ion channel regulation and function","score":0.9993000030517578,"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/T10493","display_name":"Ion channel regulation and function","score":0.9993000030517578,"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/T11818","display_name":"Nicotinic Acetylcholine Receptors Study","score":0.9988999962806702,"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/T10798","display_name":"Crystallography and molecular interactions","score":0.9983999729156494,"subfield":{"id":"https://openalex.org/subfields/1606","display_name":"Physical and Theoretical Chemistry"},"field":{"id":"https://openalex.org/fields/16","display_name":"Chemistry"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}}],"keywords":[{"id":"https://openalex.org/keywords/allosteric-regulation","display_name":"Allosteric regulation","score":0.9421082735061646},{"id":"https://openalex.org/keywords/isoflurane","display_name":"Isoflurane","score":0.7566283941268921},{"id":"https://openalex.org/keywords/propofol","display_name":"Propofol","score":0.7181199193000793},{"id":"https://openalex.org/keywords/chemistry","display_name":"Chemistry","score":0.6701613068580627},{"id":"https://openalex.org/keywords/affinities","display_name":"Affinities","score":0.6518413424491882},{"id":"https://openalex.org/keywords/biophysics","display_name":"Biophysics","score":0.617536723613739},{"id":"https://openalex.org/keywords/binding-site","display_name":"Binding site","score":0.5237289071083069},{"id":"https://openalex.org/keywords/anesthetic","display_name":"Anesthetic","score":0.48250699043273926},{"id":"https://openalex.org/keywords/ligand-gated-ion-channel","display_name":"Ligand-gated ion channel","score":0.4808826744556427},{"id":"https://openalex.org/keywords/ion-channel","display_name":"Ion channel","score":0.3961874842643738},{"id":"https://openalex.org/keywords/stereochemistry","display_name":"Stereochemistry","score":0.35849714279174805},{"id":"https://openalex.org/keywords/biochemistry","display_name":"Biochemistry","score":0.2694412171840668},{"id":"https://openalex.org/keywords/receptor","display_name":"Receptor","score":0.21729308366775513},{"id":"https://openalex.org/keywords/biology","display_name":"Biology","score":0.16423377394676208},{"id":"https://openalex.org/keywords/pharmacology","display_name":"Pharmacology","score":0.13735917210578918},{"id":"https://openalex.org/keywords/anesthesia","display_name":"Anesthesia","score":0.07229089736938477},{"id":"https://openalex.org/keywords/medicine","display_name":"Medicine","score":0.059307634830474854}],"concepts":[{"id":"https://openalex.org/C166342909","wikidata":"https://www.wikidata.org/wiki/Q845326","display_name":"Allosteric regulation","level":3,"score":0.9421082735061646},{"id":"https://openalex.org/C2776359302","wikidata":"https://www.wikidata.org/wiki/Q413918","display_name":"Isoflurane","level":2,"score":0.7566283941268921},{"id":"https://openalex.org/C2776277131","wikidata":"https://www.wikidata.org/wiki/Q422740","display_name":"Propofol","level":2,"score":0.7181199193000793},{"id":"https://openalex.org/C185592680","wikidata":"https://www.wikidata.org/wiki/Q2329","display_name":"Chemistry","level":0,"score":0.6701613068580627},{"id":"https://openalex.org/C2780283098","wikidata":"https://www.wikidata.org/wiki/Q4688960","display_name":"Affinities","level":2,"score":0.6518413424491882},{"id":"https://openalex.org/C12554922","wikidata":"https://www.wikidata.org/wiki/Q7100","display_name":"Biophysics","level":1,"score":0.617536723613739},{"id":"https://openalex.org/C107824862","wikidata":"https://www.wikidata.org/wiki/Q616005","display_name":"Binding site","level":2,"score":0.5237289071083069},{"id":"https://openalex.org/C2778162923","wikidata":"https://www.wikidata.org/wiki/Q4990531","display_name":"Anesthetic","level":2,"score":0.48250699043273926},{"id":"https://openalex.org/C82617044","wikidata":"https://www.wikidata.org/wiki/Q418536","display_name":"Ligand-gated ion channel","level":4,"score":0.4808826744556427},{"id":"https://openalex.org/C50254741","wikidata":"https://www.wikidata.org/wiki/Q62536","display_name":"Ion channel","level":3,"score":0.3961874842643738},{"id":"https://openalex.org/C71240020","wikidata":"https://www.wikidata.org/wiki/Q186011","display_name":"Stereochemistry","level":1,"score":0.35849714279174805},{"id":"https://openalex.org/C55493867","wikidata":"https://www.wikidata.org/wiki/Q7094","display_name":"Biochemistry","level":1,"score":0.2694412171840668},{"id":"https://openalex.org/C170493617","wikidata":"https://www.wikidata.org/wiki/Q208467","display_name":"Receptor","level":2,"score":0.21729308366775513},{"id":"https://openalex.org/C86803240","wikidata":"https://www.wikidata.org/wiki/Q420","display_name":"Biology","level":0,"score":0.16423377394676208},{"id":"https://openalex.org/C98274493","wikidata":"https://www.wikidata.org/wiki/Q128406","display_name":"Pharmacology","level":1,"score":0.13735917210578918},{"id":"https://openalex.org/C42219234","wikidata":"https://www.wikidata.org/wiki/Q131130","display_name":"Anesthesia","level":1,"score":0.07229089736938477},{"id":"https://openalex.org/C71924100","wikidata":"https://www.wikidata.org/wiki/Q11190","display_name":"Medicine","level":0,"score":0.059307634830474854},{"id":"https://openalex.org/C178790620","wikidata":"https://www.wikidata.org/wiki/Q11351","display_name":"Organic chemistry","level":1,"score":0.0}],"mesh":[{"descriptor_ui":"D000495","descriptor_name":"Allosteric Site","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D000495","descriptor_name":"Allosteric Site","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D000495","descriptor_name":"Allosteric Site","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D001426","descriptor_name":"Bacterial Proteins","qualifier_ui":"Q000378","qualifier_name":"metabolism","is_major_topic":false},{"descriptor_ui":"D001426","descriptor_name":"Bacterial Proteins","qualifier_ui":"Q000378","qualifier_name":"metabolism","is_major_topic":false},{"descriptor_ui":"D001426","descriptor_name":"Bacterial Proteins","qualifier_ui":"Q000378","qualifier_name":"metabolism","is_major_topic":false},{"descriptor_ui":"D001426","descriptor_name":"Bacterial Proteins","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":false},{"descriptor_ui":"D001426","descriptor_name":"Bacterial Proteins","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":false},{"descriptor_ui":"D001426","descriptor_name":"Bacterial Proteins","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":false},{"descriptor_ui":"D001665","descriptor_name":"Binding Sites","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D001665","descriptor_name":"Binding Sites","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D001665","descriptor_name":"Binding Sites","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D003198","descriptor_name":"Computer Simulation","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D003198","descriptor_name":"Computer Simulation","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D003198","descriptor_name":"Computer Simulation","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D008958","descriptor_name":"Models, Molecular","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D008958","descriptor_name":"Models, Molecular","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D008958","descriptor_name":"Models, Molecular","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D011487","descriptor_name":"Protein Conformation","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D011487","descriptor_name":"Protein Conformation","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D011487","descriptor_name":"Protein Conformation","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D013816","descriptor_name":"Thermodynamics","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D013816","descriptor_name":"Thermodynamics","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D013816","descriptor_name":"Thermodynamics","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D018681","descriptor_name":"Anesthetics, General","qualifier_ui":"Q000494","qualifier_name":"pharmacology","is_major_topic":false},{"descriptor_ui":"D018681","descriptor_name":"Anesthetics, General","qualifier_ui":"Q000494","qualifier_name":"pharmacology","is_major_topic":false},{"descriptor_ui":"D018681","descriptor_name":"Anesthetics, General","qualifier_ui":"Q000494","qualifier_name":"pharmacology","is_major_topic":false},{"descriptor_ui":"D018681","descriptor_name":"Anesthetics, General","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":false},{"descriptor_ui":"D018681","descriptor_name":"Anesthetics, General","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":false},{"descriptor_ui":"D018681","descriptor_name":"Anesthetics, General","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":false},{"descriptor_ui":"D058466","descriptor_name":"Cysteine Loop Ligand-Gated Ion Channel Receptors","qualifier_ui":"Q000037","qualifier_name":"antagonists & inhibitors","is_major_topic":false},{"descriptor_ui":"D058466","descriptor_name":"Cysteine Loop Ligand-Gated Ion Channel Receptors","qualifier_ui":"Q000037","qualifier_name":"antagonists & inhibitors","is_major_topic":false},{"descriptor_ui":"D058466","descriptor_name":"Cysteine Loop Ligand-Gated Ion Channel Receptors","qualifier_ui":"Q000037","qualifier_name":"antagonists & inhibitors","is_major_topic":false},{"descriptor_ui":"D058466","descriptor_name":"Cysteine Loop Ligand-Gated Ion Channel Receptors","qualifier_ui":"Q000378","qualifier_name":"metabolism","is_major_topic":false},{"descriptor_ui":"D058466","descriptor_name":"Cysteine Loop Ligand-Gated Ion Channel Receptors","qualifier_ui":"Q000378","qualifier_name":"metabolism","is_major_topic":false},{"descriptor_ui":"D058466","descriptor_name":"Cysteine Loop Ligand-Gated Ion Channel Receptors","qualifier_ui":"Q000378","qualifier_name":"metabolism","is_major_topic":false},{"descriptor_ui":"D058466","descriptor_name":"Cysteine Loop Ligand-Gated Ion Channel Receptors","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":false},{"descriptor_ui":"D058466","descriptor_name":"Cysteine Loop Ligand-Gated Ion Channel Receptors","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":false},{"descriptor_ui":"D058466","descriptor_name":"Cysteine Loop Ligand-Gated Ion Channel Receptors","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":false}],"locations_count":9,"locations":[{"id":"doi:10.1371/journal.pcbi.1002532","is_oa":true,"landing_page_url":"https://doi.org/10.1371/journal.pcbi.1002532","pdf_url":"https://journals.plos.org/ploscompbiol/article/file?id=10.1371/journal.pcbi.1002532&type=printable","source":{"id":"https://openalex.org/S86033158","display_name":"PLoS Computational Biology","issn_l":"1553-734X","issn":["1553-734X","1553-7358"],"is_oa":true,"is_in_doaj":true,"is_core":true,"host_organization":"https://openalex.org/P4310315706","host_organization_name":"Public Library of Science","host_organization_lineage":["https://openalex.org/P4310315706"],"host_organization_lineage_names":["Public Library of Science"],"type":"journal"},"license":"cc-by","license_id":"https://openalex.org/licenses/cc-by","version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"PLoS Computational Biology","raw_type":"journal-article"},{"id":"pmid:22693438","is_oa":false,"landing_page_url":"https://pubmed.ncbi.nlm.nih.gov/22693438","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":"PLoS computational biology","raw_type":null},{"id":"pmh:oai:CiteSeerX.psu:10.1.1.781.9464","is_oa":false,"landing_page_url":"http://citeseerx.ist.psu.edu/viewdoc/summary?doi=10.1.1.781.9464","pdf_url":null,"source":null,"license":null,"license_id":null,"version":"submittedVersion","is_accepted":false,"is_published":false,"raw_source_name":"ftp://ftp.ncbi.nlm.nih.gov/pub/pmc/f2/c7/pcbi.1002532.PMC3364936.pdf","raw_type":"text"},{"id":"pmh:oai:HAL:hal-01498104v1","is_oa":false,"landing_page_url":"https://hal.science/hal-01498104","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":"PLoS Computational Biology, 2012, 8 (5), pp.e1002532. &#x27E8;10.1371/journal.pcbi.1002532&#x27E9;","raw_type":"Journal articles"},{"id":"pmh:oai:alma.01RUT_INST:11665177180004646","is_oa":false,"landing_page_url":"https://scholarship.libraries.rutgers.edu/esploro/outputs/journalArticle/General-anesthetics-predicted-to-block-the/991031666022304646","pdf_url":null,"source":{"id":"https://openalex.org/S4210197018","display_name":"View","issn_l":"2688-268X","issn":["2688-268X","2688-3988"],"is_oa":false,"is_in_doaj":true,"is_core":true,"host_organization":"https://openalex.org/P4310320595","host_organization_name":"Wiley","host_organization_lineage":["https://openalex.org/P4310320595"],"host_organization_lineage_names":["Wiley"],"type":"journal"},"license":null,"license_id":null,"version":"submittedVersion","is_accepted":false,"is_published":false,"raw_source_name":null,"raw_type":"Article"},{"id":"pmh:oai:doaj.org/article:6189513b39334f1ba4e13dd9a82ce48a","is_oa":true,"landing_page_url":"https://doaj.org/article/6189513b39334f1ba4e13dd9a82ce48a","pdf_url":null,"source":{"id":"https://openalex.org/S4306401280","display_name":"DOAJ (DOAJ: Directory of Open Access Journals)","issn_l":null,"issn":null,"is_oa":false,"is_in_doaj":false,"is_core":false,"host_organization":null,"host_organization_name":null,"host_organization_lineage":[],"host_organization_lineage_names":[],"type":"repository"},"license":"cc-by-sa","license_id":"https://openalex.org/licenses/cc-by-sa","version":"submittedVersion","is_accepted":false,"is_published":false,"raw_source_name":"PLoS Computational Biology, Vol 8, Iss 5, p e1002532 (2012)","raw_type":"article"},{"id":"pmh:oai:europepmc.org:2378354","is_oa":true,"landing_page_url":"https://www.ncbi.nlm.nih.gov/pmc/articles/3364936","pdf_url":null,"source":{"id":"https://openalex.org/S4306400806","display_name":"Europe PMC (PubMed Central)","issn_l":null,"issn":null,"is_oa":false,"is_in_doaj":false,"is_core":false,"host_organization":"https://openalex.org/I1303153112","host_organization_name":"European Bioinformatics Institute","host_organization_lineage":["https://openalex.org/I1303153112"],"host_organization_lineage_names":[],"type":"repository"},"license":"cc-by","license_id":"https://openalex.org/licenses/cc-by","version":"submittedVersion","is_accepted":false,"is_published":false,"raw_source_name":null,"raw_type":"Text"},{"id":"pmh:oai:figshare.com:article/124370","is_oa":true,"landing_page_url":"https://figshare.com/articles/General_Anesthetics_Predicted_to_Block_the_GLIC_Pore_with_Micromolar_Affinity/124370","pdf_url":null,"source":{"id":"https://openalex.org/S4377196282","display_name":"Figshare","issn_l":null,"issn":null,"is_oa":false,"is_in_doaj":false,"is_core":false,"host_organization":"https://openalex.org/I4210132348","host_organization_name":"Figshare (United Kingdom)","host_organization_lineage":["https://openalex.org/I4210132348"],"host_organization_lineage_names":[],"type":"repository"},"license":"cc-by","license_id":"https://openalex.org/licenses/cc-by","version":"submittedVersion","is_accepted":false,"is_published":false,"raw_source_name":"","raw_type":"Dataset"},{"id":"pmh:oai:scholarshare.temple.edu:20.500.12613/5464","is_oa":true,"landing_page_url":"http://hdl.handle.net/20.500.12613/5464","pdf_url":null,"source":{"id":"https://openalex.org/S4306402624","display_name":"TUScholarShare (Temple University)","issn_l":null,"issn":null,"is_oa":false,"is_in_doaj":false,"is_core":false,"host_organization":"https://openalex.org/I84392919","host_organization_name":"Temple University","host_organization_lineage":["https://openalex.org/I84392919"],"host_organization_lineage_names":[],"type":"repository"},"license":"cc-by","license_id":"https://openalex.org/licenses/cc-by","version":"submittedVersion","is_accepted":false,"is_published":false,"raw_source_name":"","raw_type":"Journal Article"}],"best_oa_location":{"id":"doi:10.1371/journal.pcbi.1002532","is_oa":true,"landing_page_url":"https://doi.org/10.1371/journal.pcbi.1002532","pdf_url":"https://journals.plos.org/ploscompbiol/article/file?id=10.1371/journal.pcbi.1002532&type=printable","source":{"id":"https://openalex.org/S86033158","display_name":"PLoS Computational Biology","issn_l":"1553-734X","issn":["1553-734X","1553-7358"],"is_oa":true,"is_in_doaj":true,"is_core":true,"host_organization":"https://openalex.org/P4310315706","host_organization_name":"Public Library of Science","host_organization_lineage":["https://openalex.org/P4310315706"],"host_organization_lineage_names":["Public Library of Science"],"type":"journal"},"license":"cc-by","license_id":"https://openalex.org/licenses/cc-by","version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"PLoS Computational Biology","raw_type":"journal-article"},"sustainable_development_goals":[{"score":0.5199999809265137,"display_name":"Clean water and sanitation","id":"https://metadata.un.org/sdg/6"}],"awards":[{"id":"https://openalex.org/G6630169851","display_name":null,"funder_award_id":"GM055876","funder_id":"https://openalex.org/F4320332161","funder_display_name":"National Institutes of Health"}],"funders":[{"id":"https://openalex.org/F4320306076","display_name":"National Science Foundation","ror":"https://ror.org/021nxhr62"},{"id":"https://openalex.org/F4320332161","display_name":"National Institutes of Health","ror":"https://ror.org/01cwqze88"}],"has_content":{"grobid_xml":true,"pdf":true},"content_urls":{"pdf":"https://content.openalex.org/works/W2073025354.pdf","grobid_xml":"https://content.openalex.org/works/W2073025354.grobid-xml"},"referenced_works_count":55,"referenced_works":["https://openalex.org/W185137928","https://openalex.org/W576610066","https://openalex.org/W1606968589","https://openalex.org/W1668093331","https://openalex.org/W1908444272","https://openalex.org/W1956349310","https://openalex.org/W1972759464","https://openalex.org/W1974030600","https://openalex.org/W1975239375","https://openalex.org/W1987721189","https://openalex.org/W1989195611","https://openalex.org/W1989992848","https://openalex.org/W1991964259","https://openalex.org/W1992450814","https://openalex.org/W1994451591","https://openalex.org/W1999423218","https://openalex.org/W1999936059","https://openalex.org/W2003468829","https://openalex.org/W2015989783","https://openalex.org/W2017829285","https://openalex.org/W2018174553","https://openalex.org/W2027256384","https://openalex.org/W2027408247","https://openalex.org/W2029667189","https://openalex.org/W2033982388","https://openalex.org/W2035687084","https://openalex.org/W2044027541","https://openalex.org/W2049434430","https://openalex.org/W2063157730","https://openalex.org/W2069123478","https://openalex.org/W2069123867","https://openalex.org/W2074957858","https://openalex.org/W2077954341","https://openalex.org/W2082204925","https://openalex.org/W2083991928","https://openalex.org/W2084398419","https://openalex.org/W2085080655","https://openalex.org/W2085913208","https://openalex.org/W2088909919","https://openalex.org/W2089367180","https://openalex.org/W2091140270","https://openalex.org/W2104389482","https://openalex.org/W2114524505","https://openalex.org/W2117421213","https://openalex.org/W2121987522","https://openalex.org/W2140151763","https://openalex.org/W2147126631","https://openalex.org/W2150981663","https://openalex.org/W2152959849","https://openalex.org/W2155549085","https://openalex.org/W2158573665","https://openalex.org/W2165419593","https://openalex.org/W2169686328","https://openalex.org/W2171268876","https://openalex.org/W2184899155"],"related_works":["https://openalex.org/W1979645639","https://openalex.org/W2081575491","https://openalex.org/W2909437011","https://openalex.org/W2076667091","https://openalex.org/W1865643442","https://openalex.org/W2794085627","https://openalex.org/W4221122329","https://openalex.org/W1902379737","https://openalex.org/W4200375242","https://openalex.org/W2034352765"],"abstract_inverted_index":{"Although":[0],"general":[1,77],"anesthetics":[2,78,238],"are":[3,95,113,221],"known":[4],"to":[5,36,51,62,108,126,148,196,217,226],"modulate":[6],"the":[7,14,24,41,68,76,83,109,122,141,152,218,244,249],"activity":[8],"of":[9,30,40,44,71,82,104,140,194,213],"ligand-gated":[10],"ion":[11],"channels":[12],"in":[13,120],"Cys-loop":[15],"superfamily,":[16],"there":[17],"is":[18,88,124,146,162,183],"at":[19,151,174],"present":[20],"neither":[21],"consensus":[22],"on":[23],"underlying":[25],"mechanisms,":[26],"nor":[27],"predictive":[28],"models":[29,34],"this":[31,188],"modulation.":[32],"Viable":[33],"need":[35],"offer":[37],"quantitative":[38],"assessment":[39],"relative":[42],"importance":[43],"several":[45],"identified":[46,201],"anesthetic":[47],"binding":[48,103,193],"sites.":[49],"However,":[50],"date,":[52],"precise":[53],"affinity":[54,242],"data":[55],"for":[56,97,116,155,180,230,235,243,248],"individual":[57],"sites":[58],"has":[59],"been":[60],"challenging":[61],"obtain":[63],"by":[64,75,90,158,171,202],"biophysical":[65],"means.":[66],"Here,":[67],"likely":[69],"role":[70],"pore":[72,123,145,169],"block":[73,170],"inhibition":[74,157,182],"isoflurane":[79,105,214,231],"and":[80,100,106,129,160,215,224,232],"propofol":[81,107,161,172,195,216],"prokaryotic":[84],"pentameric":[85],"channel":[86],"GLIC":[87,110,144],"investigated":[89],"molecular":[91,137],"simulations.":[92],"Microscopic":[93],"affinities":[94,166],"calculated":[96],"both":[98,237],"single":[99],"double":[101],"occupancy":[102],"pore.":[111,251],"Computations":[112],"carried":[114],"out":[115],"an":[117,197],"open-pore":[118],"conformation":[119,132],"which":[121,156,181,205],"restrained":[125],"crystallographic":[127],"radius,":[128],"a":[130,208,240],"closed-pore":[131],"that":[133,168,187],"results":[134],"from":[135,192],"unrestrained":[136],"dynamics":[138],"equilibration":[139],"structure.":[142],"The":[143],"predicted":[147],"be":[149,227],"blocked":[150],"micromolar":[153],"concentrations":[154,177],"isofluorane":[159],"observed":[163],"experimentally.":[164],"Calculated":[165],"suggest":[167],"occurs":[173],"signifcantly":[175],"lower":[176,241],"than":[178,247],"those":[179],"observed:":[184],"we":[185],"argue":[186],"discrepancy":[189],"may":[190,206],"result":[191],"allosteric":[198,219,245],"site":[199,220,246],"recently":[200],"X-ray":[203],"crystallography,":[204],"cause":[207],"competing":[209],"gain-of-function":[210],"effect.":[211],"Affinities":[212],"also":[222],"calculated,":[223],"shown":[225],"3":[228],"mM":[229],"10":[233],"\u03bcM":[234],"propofol;":[236],"have":[239],"unoccupied":[250]},"counts_by_year":[{"year":2025,"cited_by_count":2},{"year":2024,"cited_by_count":2},{"year":2023,"cited_by_count":2},{"year":2022,"cited_by_count":1},{"year":2021,"cited_by_count":4},{"year":2020,"cited_by_count":2},{"year":2019,"cited_by_count":3},{"year":2018,"cited_by_count":11},{"year":2017,"cited_by_count":6},{"year":2016,"cited_by_count":8},{"year":2015,"cited_by_count":4},{"year":2014,"cited_by_count":7},{"year":2013,"cited_by_count":9},{"year":2012,"cited_by_count":2}],"updated_date":"2026-05-06T08:25:59.206177","created_date":"2025-10-10T00:00:00"}
