{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2026,9,3]],"date-time":"2026-09-03T22:33:22Z","timestamp":1788474802467,"version":"build-2803163510"},"reference-count":77,"publisher":"Elsevier BV","license":[{"start":{"date-parts":[[2021,5,1]],"date-time":"2021-05-01T00:00:00Z","timestamp":1619827200000},"content-version":"tdm","delay-in-days":0,"URL":"https:\/\/www.elsevier.com\/tdm\/userlicense\/1.0\/"},{"start":{"date-parts":[[2021,5,1]],"date-time":"2021-05-01T00:00:00Z","timestamp":1619827200000},"content-version":"tdm","delay-in-days":0,"URL":"https:\/\/www.elsevier.com\/legal\/tdmrep-license"},{"start":{"date-parts":[[2021,2,20]],"date-time":"2021-02-20T00:00:00Z","timestamp":1613779200000},"content-version":"vor","delay-in-days":0,"URL":"http:\/\/creativecommons.org\/licenses\/by-nc-nd\/4.0\/"}],"content-domain":{"domain":["elsevier.com","sciencedirect.com"],"crossmark-restriction":true},"short-container-title":["Ecotoxicology and Environmental Safety"],"published-print":{"date-parts":[[2021,5]]},"DOI":"10.1016\/j.ecoenv.2021.112086","type":"journal-article","created":{"date-parts":[[2021,2,25]],"date-time":"2021-02-25T00:25:23Z","timestamp":1614212723000},"page":"112086","update-policy":"https:\/\/doi.org\/10.1016\/elsevier_cm_policy","source":"Crossref","is-referenced-by-count":14,"special_numbering":"C","title":["A computational insight into endocrine disruption by polychlorinated biphenyls via non-covalent interactions with human nuclear receptors"],"prefix":"10.1016","volume":"214","author":[{"given":"Lukman K.","family":"Akinola","sequence":"first","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Adamu","family":"Uzairu","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Gideon A.","family":"Shallangwa","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Stephen E.","family":"Abechi","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]}],"member":"78","reference":[{"key":"10.1016\/j.ecoenv.2021.112086_bib1","doi-asserted-by":"crossref","first-page":"233","DOI":"10.1002\/jat.4039","article-title":"Theoretical study on endocrine disrupting effects of polychlorinated dibenzo-p-dioxins using molecular docking simulation","volume":"41","author":"Akinola","year":"2021","journal-title":"J. Appl. Toxicol."},{"key":"10.1016\/j.ecoenv.2021.112086_bib2","doi-asserted-by":"crossref","first-page":"49","DOI":"10.1093\/toxsci\/kfi063","article-title":"Structural requirements for the interaction of 91 hydroxylated polychlorinated biphenyls with estrogen and thyroid hormone receptors","volume":"84","author":"Arulmozhiraja","year":"2005","journal-title":"Toxicol. Sci."},{"key":"10.1016\/j.ecoenv.2021.112086_bib3","doi-asserted-by":"crossref","first-page":"484","DOI":"10.1080\/15287394.2020.1756592","article-title":"Human exposure to synthetic endocrine disrupting chemicals (S-EDCs) is generally negligible as compared to natural compounds with higher or comparable endocrine activity. How to evaluate the risk of the S-EDCs","volume":"83","author":"Autrup","year":"2020","journal-title":"J. Toxicol. Environ. Health"},{"key":"10.1016\/j.ecoenv.2021.112086_bib4","doi-asserted-by":"crossref","first-page":"1","DOI":"10.1016\/j.coemr.2019.04.008","article-title":"Mechanisms of endocrine disruption through nuclear receptors and related pathways","volume":"7","author":"Balaguer","year":"2019","journal-title":"Curr. Opin. Endocr. Metab. Res."},{"key":"10.1016\/j.ecoenv.2021.112086_bib5","doi-asserted-by":"crossref","first-page":"141","DOI":"10.1016\/S0300-483X(00)00368-1","article-title":"Effect of highly bioaccumulated polychlorinated biphenyl congeners on estrogen and androgen receptor activity","volume":"158","author":"Bonefeld-J\u00f8rgensen","year":"2001","journal-title":"Toxicology"},{"issue":"13","key":"10.1016\/j.ecoenv.2021.112086_bib6","doi-asserted-by":"crossref","first-page":"847","DOI":"10.1056\/NEJM199409293311306","article-title":"The molecular basis of thyroid hormone action","volume":"331","author":"Brent","year":"1994","journal-title":"New Engl. J. Med."},{"key":"10.1016\/j.ecoenv.2021.112086_bib7","doi-asserted-by":"crossref","first-page":"3035","DOI":"10.1172\/JCI60047","article-title":"Mechanisms of thyroid hormone action","volume":"122","author":"Brent","year":"2012","journal-title":"J. Clin. Investig."},{"key":"10.1016\/j.ecoenv.2021.112086_bib8","doi-asserted-by":"crossref","first-page":"753","DOI":"10.1016\/S0039-128X(99)00054-9","article-title":"Discovery of the role of dihydrotestosterone in androgen action","volume":"64","author":"Bruchovsky","year":"1999","journal-title":"Steroids"},{"key":"10.1016\/j.ecoenv.2021.112086_bib9","doi-asserted-by":"crossref","first-page":"1053","DOI":"10.1016\/S0278-6915(00)00094-6","article-title":"Consequences of Aroclor\u00ae 1254 ingestion on the menstrual cycle of rhesus (Macaca mulatta) monkeys","volume":"38","author":"Bryce","year":"2000","journal-title":"Food Chem. Toxicol."},{"key":"10.1016\/j.ecoenv.2021.112086_bib10","doi-asserted-by":"crossref","first-page":"1061","DOI":"10.4161\/epi.25811","article-title":"Androgen receptor activation by polychlorinated biphenyls","volume":"8","author":"Casati","year":"2013","journal-title":"Epigenetics"},{"issue":"4","key":"10.1016\/j.ecoenv.2021.112086_bib11","doi-asserted-by":"crossref","first-page":"273","DOI":"10.1289\/ehp.99107273","article-title":"Potential mechanisms of thyroid disruption in humans: interaction of organochlorine compounds with thyroid receptor, transthyretin, and thyroid-binding globulin","volume":"107","author":"Cheek","year":"1999","journal-title":"Environ. Health Perspect."},{"key":"10.1016\/j.ecoenv.2021.112086_bib12","doi-asserted-by":"crossref","first-page":"265","DOI":"10.3727\/105221617X14968563796227","article-title":"GC-1: a thyromimetic with multiple therapeutic applications in liver disease","volume":"17","author":"Columbano","year":"2017","journal-title":"Gene Expr."},{"key":"10.1016\/j.ecoenv.2021.112086_bib13","doi-asserted-by":"crossref","first-page":"111","DOI":"10.1006\/taap.1997.8169","article-title":"Hydroxylated polychlorinated biphenyls (PCBs) as estrogens and antiestrogens: structure activity relationships","volume":"145","author":"Connor","year":"1997","journal-title":"Toxicol. Appl. Pharmacol."},{"issue":"2","key":"10.1016\/j.ecoenv.2021.112086_bib14","doi-asserted-by":"crossref","first-page":"191","DOI":"10.1097\/01.ede.0000152913.12393.86","article-title":"Polychlorinated biphenyls and menstrual cycle characteristics","volume":"16","author":"Cooper","year":"2005","journal-title":"Epidemiology"},{"key":"10.1016\/j.ecoenv.2021.112086_bib15","series-title":"Endocrine Disruption and Human Health","first-page":"27","article-title":"How could endocrine disrupters affect human health","author":"Darbre","year":"2015"},{"key":"10.1016\/j.ecoenv.2021.112086_bib16","series-title":"Discovery Studio Visualizer, v20.1.0.19295","author":"Dassault Syst\u00e8mes BIOVIA","year":"2019"},{"issue":"1","key":"10.1016\/j.ecoenv.2021.112086_bib17","first-page":"3","article-title":"Androgen receptor structure, function and biology: from bench to bedside","volume":"37","author":"Davey","year":"2016","journal-title":"Clin. Biochem. Rev."},{"key":"10.1016\/j.ecoenv.2021.112086_bib18","doi-asserted-by":"crossref","first-page":"543","DOI":"10.1055\/s-0030-1252034","article-title":"The impact of endocrine disruptors on endocrine targets","volume":"42","author":"Diamanti-Kandarakis","year":"2010","journal-title":"Horm. Metab. Res."},{"key":"10.1016\/j.ecoenv.2021.112086_bib19","doi-asserted-by":"crossref","first-page":"341","DOI":"10.1007\/s00345-003-0365-9","article-title":"Androgens and male fertility","volume":"21","author":"Dohle","year":"2003","journal-title":"World J. Urol."},{"key":"10.1016\/j.ecoenv.2021.112086_bib20","doi-asserted-by":"crossref","first-page":"135","DOI":"10.1007\/s11356-010-0392-1","article-title":"Applications of polychlorinated biphenyls","volume":"18","author":"Erickson","year":"2011","journal-title":"Environ. Sci. Pollut. Res."},{"issue":"11","key":"10.1016\/j.ecoenv.2021.112086_bib21","doi-asserted-by":"crossref","first-page":"1825","DOI":"10.1177\/0748233715587849","article-title":"Polychlorinated biphenyls: new evidence from the last decade","volume":"32","author":"Faroon","year":"2016","journal-title":"Toxicol. Ind. Health"},{"key":"10.1016\/j.ecoenv.2021.112086_bib22","first-page":"49","article-title":"Symposium overview: toxicity of non-coplanar PCBs","volume":"41","author":"Fischer","year":"1998","journal-title":"Toxicol. Sci."},{"key":"10.1016\/j.ecoenv.2021.112086_bib23","first-page":"233","article-title":"Effects of PCB 126 on primary immune organ development in chicken embryos","volume":"56","author":"Fox","year":"1999","journal-title":"J. Toxicol. Environ. Health"},{"issue":"5","key":"10.1016\/j.ecoenv.2021.112086_bib24","doi-asserted-by":"crossref","first-page":"516","DOI":"10.1289\/ehp.6672","article-title":"Polychlorinated biphenyls (PCBs) exert thyroid hormone-like effects in the fetal rat brain but do not bind to thyroid hormone receptors","volume":"112","author":"Gauger","year":"2004","journal-title":"Environ. Health Perspect."},{"issue":"6","key":"10.1016\/j.ecoenv.2021.112086_bib25","doi-asserted-by":"crossref","first-page":"511","DOI":"10.1080\/10408449891344263","article-title":"Dioxin-like and non-dioxin-like toxic effects of polychlorinated biphenyls (PCBs): implications for risk assessment","volume":"28","author":"Giesy","year":"1998","journal-title":"Crit. Rev. Toxicol."},{"issue":"3","key":"10.1016\/j.ecoenv.2021.112086_bib26","doi-asserted-by":"crossref","first-page":"245","DOI":"10.3109\/10408444.2014.999365","article-title":"Metabolism and metabolites of polychlorinated biphenyls","volume":"45","author":"Grimm","year":"2015","journal-title":"Crit. Rev. Toxicol."},{"issue":"6","key":"10.1016\/j.ecoenv.2021.112086_bib27","first-page":"117","article-title":"Growth abnormalities in the population exposed in utero and early postnatally to polychlorinated biphenyls and dibenzofurans","volume":"103","author":"Guo","year":"1995","journal-title":"Environ. Health Perspect."},{"issue":"2","key":"10.1016\/j.ecoenv.2021.112086_bib28","doi-asserted-by":"crossref","first-page":"131","DOI":"10.1016\/0269-7491(94)90079-5","article-title":"Polychlorinated biphenyls (PCBs) in the British environment: sinks, sources and temporal trends","volume":"87","author":"Harrad","year":"1994","journal-title":"Environ. Pollut."},{"issue":"3","key":"10.1016\/j.ecoenv.2021.112086_bib29","doi-asserted-by":"crossref","first-page":"384","DOI":"10.1016\/S0006-291X(02)02659-1","article-title":"Polychlorinated biphenyls suppress thyroid hormone-induced transactivation","volume":"299","author":"Iwasaki","year":"2002","journal-title":"Biochem. Biophys. Res. Commun."},{"key":"10.1016\/j.ecoenv.2021.112086_bib30","doi-asserted-by":"crossref","first-page":"1","DOI":"10.1016\/j.chemosphere.2020.128447","article-title":"Assessment of the endocrine-disrupting potential of halogenated parabens: an in silico approach","volume":"264","author":"Jakopin","year":"2021","journal-title":"Chemosphere"},{"key":"10.1016\/j.ecoenv.2021.112086_bib31","doi-asserted-by":"crossref","first-page":"237","DOI":"10.1016\/0890-6238(93)90230-5","article-title":"Estrogenic and antiestrogenic actions of PCBs in the female rat: in vitro and in vivo studies","volume":"7","author":"Jansen","year":"1993","journal-title":"Reprod. Toxicol."},{"key":"10.1016\/j.ecoenv.2021.112086_bib32","doi-asserted-by":"crossref","first-page":"1609","DOI":"10.1016\/j.chemosphere.2007.08.002","article-title":"Effect of mono-ortho and di-ortho substituted polychlorinated biphenyl (PCB) congeners on leopard frog survival and sexual development","volume":"70","author":"Jofre","year":"2008","journal-title":"Chemosphere"},{"issue":"12","key":"10.1016\/j.ecoenv.2021.112086_bib33","doi-asserted-by":"crossref","first-page":"769","DOI":"10.1289\/ehp.98106769","article-title":"Interactions between methylsulfonyl PCBs and glucocorticoid receptor","volume":"106","author":"Johansson","year":"1998","journal-title":"Environ. Health Perspect."},{"issue":"9","key":"10.1016\/j.ecoenv.2021.112086_bib34","doi-asserted-by":"crossref","first-page":"518","DOI":"10.1016\/j.tips.2013.07.003","article-title":"Glucocorticoid receptor signaling in health and disease","volume":"34","author":"Kadmiel","year":"2013","journal-title":"Trends Pharmacol. Sci."},{"key":"10.1016\/j.ecoenv.2021.112086_bib35","doi-asserted-by":"crossref","first-page":"1616","DOI":"10.3390\/molecules25071616","article-title":"Computational study of drugs targeting nuclear receptors","volume":"25","author":"Kenda","year":"2020","journal-title":"Molecules"},{"issue":"14","key":"10.1016\/j.ecoenv.2021.112086_bib36","doi-asserted-by":"crossref","first-page":"2905","DOI":"10.1093\/nar\/29.14.2905","article-title":"Estrogen receptor interaction with estrogen response elements","volume":"29","author":"Klinge","year":"2001","journal-title":"Nucleic Acids Res."},{"key":"10.1016\/j.ecoenv.2021.112086_bib37","doi-asserted-by":"crossref","first-page":"1254","DOI":"10.1021\/ci400649p","article-title":"Endocrine Disruptome \u2013 an open source prediction tool for assessing endocrine disruption potential through nuclear receptor binding","volume":"54","author":"Kol\u0161ek","year":"2014","journal-title":"J. Chem. Inf. Model."},{"issue":"2","key":"10.1016\/j.ecoenv.2021.112086_bib38","doi-asserted-by":"crossref","first-page":"228","DOI":"10.1002\/(SICI)1097-0134(19991101)37:2<228::AID-PROT8>3.0.CO;2-8","article-title":"Evaluation of the FLEXX incremental construction algorithm for protein-ligand docking","volume":"37","author":"Kramer","year":"1999","journal-title":"Proteins"},{"key":"10.1016\/j.ecoenv.2021.112086_bib39","doi-asserted-by":"crossref","first-page":"4252","DOI":"10.1210\/endo.139.10.6216","article-title":"Interaction of estrogenic chemicals and phytoestrogens with estrogen receptor \u03b2","volume":"139","author":"Kuiper","year":"1998","journal-title":"Endocrinology"},{"key":"10.1016\/j.ecoenv.2021.112086_bib40","doi-asserted-by":"crossref","first-page":"450","DOI":"10.1016\/j.mce.2011.03.024","article-title":"Folding of the glucocorticoid receptor N-terminal transactivation function: dynamics and regulation","volume":"348","author":"Kumar","year":"2012","journal-title":"Mol. Cell. Endocrinol."},{"key":"10.1016\/j.ecoenv.2021.112086_bib41","doi-asserted-by":"crossref","first-page":"1777","DOI":"10.1172\/JCI114906","article-title":"Nuclear thyroid hormone receptors","volume":"86","author":"Lazar","year":"1990","journal-title":"J. Clin. Investig."},{"key":"10.1016\/j.ecoenv.2021.112086_bib42","series-title":"Human Anatomy and Physiology","author":"Marieb","year":"2019"},{"key":"10.1016\/j.ecoenv.2021.112086_bib43","doi-asserted-by":"crossref","first-page":"91","DOI":"10.1152\/physrev.00010.2007","article-title":"Estradiol and the developing brain","volume":"88","author":"McCarthy","year":"2008","journal-title":"Physiol. Rev."},{"key":"10.1016\/j.ecoenv.2021.112086_bib44","doi-asserted-by":"crossref","first-page":"122","DOI":"10.3109\/19396360903443658","article-title":"Exposure to polychlorinated biphenyls (PCBs) and male reproduction","volume":"56","author":"Meeker","year":"2010","journal-title":"Syst. Biol. Reprod. Med."},{"key":"10.1016\/j.ecoenv.2021.112086_bib45","doi-asserted-by":"crossref","first-page":"667","DOI":"10.1021\/es025809l","article-title":"Global distribution and budget of PCBs and HCB in background surface soils: implications for sources and environmental processes","volume":"37","author":"Meijer","year":"2003","journal-title":"Environ. Sci. Technol."},{"key":"10.1016\/j.ecoenv.2021.112086_bib46","series-title":"Williams Textbook of Endocrinology","first-page":"2","article-title":"Principles of endocrinology","author":"Melmed","year":"2020"},{"key":"10.1016\/j.ecoenv.2021.112086_bib47","doi-asserted-by":"crossref","first-page":"18195","DOI":"10.1074\/jbc.M310531200","article-title":"Polychlorinated biphenyls suppress thyroid hormone receptor-mediated transcription through a novel mechanism","volume":"279","author":"Miyazaki","year":"2004","journal-title":"J. Biol. Chem."},{"key":"10.1016\/j.ecoenv.2021.112086_bib48","doi-asserted-by":"crossref","first-page":"49","DOI":"10.1016\/0014-5793(96)00782-X","article-title":"ER\u03b2: identification and characterization of a novel human estrogen receptor","volume":"392","author":"Mosselman","year":"1996","journal-title":"FEBS Lett."},{"issue":"21","key":"10.1016\/j.ecoenv.2021.112086_bib49","doi-asserted-by":"crossref","first-page":"11603","DOI":"10.1073\/pnas.97.21.11603","article-title":"Nongenomic actions of estrogens and xenoestrogens by binding at a plasma membrane receptor unrelated to estrogen receptor \u03b1 and estrogen receptor \u03b2","volume":"97","author":"Nadal","year":"2000","journal-title":"Proc. Natl. Acad. Sci. U. S. A."},{"key":"10.1016\/j.ecoenv.2021.112086_bib50","doi-asserted-by":"crossref","first-page":"325","DOI":"10.1016\/j.chemosphere.2015.04.075","article-title":"Computational study of affinity to nuclear receptors for cosmetic ingredients","volume":"135","author":"Plo\u0161nik","year":"2015","journal-title":"Chemosphere"},{"key":"10.1016\/j.ecoenv.2021.112086_bib51","doi-asserted-by":"crossref","first-page":"185","DOI":"10.1006\/taap.2002.9371","article-title":"Polychlorinated biphenyls interfere with androgen-induced transcription activation and hormone binding","volume":"179","author":"Portigal","year":"2002","journal-title":"Toxicol. Appl. Pharmacol."},{"key":"10.1016\/j.ecoenv.2021.112086_bib52","doi-asserted-by":"crossref","first-page":"91","DOI":"10.1007\/s40618-016-0539-0","article-title":"Lactational exposure effect of polychlorinated biphenyl on rat sertoli cell markers and functional regulators in prepuberal and puberal F1 offspring","volume":"40","author":"Priya","year":"2016","journal-title":"J. Endocrinol. Investig."},{"key":"10.1016\/j.ecoenv.2021.112086_bib53","doi-asserted-by":"crossref","first-page":"818","DOI":"10.1177\/1933719117699707","article-title":"Impact of lactational exposure to polychlorinated biphenyl causes epigenetic modification and impairs sertoli cells functional regulators in F1 progeny","volume":"25","author":"Priya","year":"2017","journal-title":"Reprod. Sci."},{"key":"10.1016\/j.ecoenv.2021.112086_bib54","doi-asserted-by":"crossref","first-page":"2894","DOI":"10.1021\/acs.jmedchem.8b01105","article-title":"Nuclear receptors database including negative data (NR-DBIND): a database dedicated to nuclear receptors binding data including negative data and pharmacological profile","volume":"62","author":"R\u00e9au","year":"2019","journal-title":"J. Med. Chem."},{"key":"10.1016\/j.ecoenv.2021.112086_bib55","doi-asserted-by":"crossref","first-page":"3871","DOI":"10.1021\/es063004y","article-title":"Polychlorinated biphenyls in Chinese surface soils","volume":"41","author":"Ren","year":"2007","journal-title":"Environ. Sci. Technol."},{"key":"10.1016\/j.ecoenv.2021.112086_bib56","doi-asserted-by":"crossref","first-page":"537","DOI":"10.1136\/jech.55.8.537","article-title":"Polychlorinated biphenyls (PCBs) and neurological development in children: a systematic review","volume":"55","author":"Ribas-Fit\u00f3","year":"2001","journal-title":"J. Epidemiol. Community Health"},{"issue":"4","key":"10.1016\/j.ecoenv.2021.112086_bib57","doi-asserted-by":"crossref","first-page":"585","DOI":"10.1242\/jcs.00247","article-title":"The nuclear receptor superfamily","volume":"116","author":"Robinson-Rechavi","year":"2003","journal-title":"J. Cell Sci."},{"issue":"2","key":"10.1016\/j.ecoenv.2021.112086_bib58","doi-asserted-by":"crossref","first-page":"109","DOI":"10.3109\/10408449709021615","article-title":"Aryl hydrocarbon receptor-mediated signal transduction","volume":"27","author":"Rowlands","year":"1997","journal-title":"Crit. Rev. Toxicol."},{"issue":"10","key":"10.1016\/j.ecoenv.2021.112086_bib59","doi-asserted-by":"crossref","first-page":"1278","DOI":"10.1289\/ehp.6126","article-title":"Effects of polychlorinated biphenyls on estrogen receptor-\u03b2 expression in the anteroventral periventricular nucleus","volume":"111","author":"Salama","year":"2003","journal-title":"Environ. Health Perspect."},{"key":"10.1016\/j.ecoenv.2021.112086_bib60","doi-asserted-by":"crossref","first-page":"6","DOI":"10.1021\/tx100231n","article-title":"Endocrine disrupting chemicals targeting estrogen receptor signaling: identification and mechanisms of action","volume":"24","author":"Shanle","year":"2011","journal-title":"Chem. Res. Toxicol."},{"key":"10.1016\/j.ecoenv.2021.112086_bib61","doi-asserted-by":"crossref","first-page":"3172","DOI":"10.1039\/B517914A","article-title":"Advances in methods and algorithms in a modern quantum chemistry program package","volume":"8","author":"Shao","year":"2006","journal-title":"Phys. Chem. Chem. Phys."},{"key":"10.1016\/j.ecoenv.2021.112086_bib62","doi-asserted-by":"crossref","first-page":"112","DOI":"10.1016\/j.tox.2011.08.001","article-title":"Characterization of steroid hormone receptor activities in 100 hydroxylated polychlorinated biphenyls, including congeners identified in humans","volume":"289","author":"Takeuchi","year":"2011","journal-title":"Toxicology"},{"key":"10.1016\/j.ecoenv.2021.112086_bib63","doi-asserted-by":"crossref","first-page":"67","DOI":"10.1016\/j.tox.2005.10.008","article-title":"Selected polychlorobiphenyls congeners bind to estrogen receptor alpha in human umbilical vascular endothelial (HUVE) cells modulating angiogenesis","volume":"218","author":"Tavolari","year":"2006","journal-title":"Toxicology"},{"key":"10.1016\/j.ecoenv.2021.112086_bib64","doi-asserted-by":"crossref","first-page":"3315","DOI":"10.1021\/jm051197e","article-title":"MolDock: a new technique for high-accuracy molecular docking","volume":"49","author":"Thomsen","year":"2006","journal-title":"J. Med. Chem."},{"key":"10.1016\/j.ecoenv.2021.112086_bib65","doi-asserted-by":"crossref","DOI":"10.1016\/j.mce.2019.110665","article-title":"Nuclear receptors are the major targets of endocrine disrupting chemicals","volume":"502","author":"Toporova","year":"2020","journal-title":"Mol. Cell. Endocrinol."},{"key":"10.1016\/j.ecoenv.2021.112086_bib66","doi-asserted-by":"crossref","first-page":"8290","DOI":"10.1021\/acs.est.6b01723","article-title":"Effects and location of coplanar and noncoplanar PCB in a lipid bilayer: a solid-state NMR study","volume":"50","author":"Totland","year":"2016","journal-title":"Environ. Sci. Technol."},{"issue":"5","key":"10.1016\/j.ecoenv.2021.112086_bib67","doi-asserted-by":"crossref","first-page":"626","DOI":"10.1289\/ehp.10686","article-title":"Long-term effects of polychlorinated biphenyls and dioxins on pregnancy outcomes in women affected by the Yusho incident","volume":"116","author":"Tsukimori","year":"2008","journal-title":"Environ. Health Perspect."},{"key":"10.1016\/j.ecoenv.2021.112086_bib68","doi-asserted-by":"crossref","first-page":"154","DOI":"10.1016\/j.ecoenv.2018.12.071","article-title":"Computational study suggesting reconsideration of BPA analogues based on their endocrine disrupting potential estimated by binding affinities to nuclear receptors","volume":"171","author":"Usman","year":"2019","journal-title":"Ecotoxicol. Environ. Saf."},{"issue":"Suppl 1","key":"10.1016\/j.ecoenv.2021.112086_bib69","doi-asserted-by":"crossref","first-page":"S16","DOI":"10.1186\/1751-0147-54-S1-S16","article-title":"Biological and toxicological effects of non-dioxin like PCBs","volume":"54","author":"Viluksela","year":"2012","journal-title":"Acta Vet. Scand."},{"key":"10.1016\/j.ecoenv.2021.112086_bib70","doi-asserted-by":"crossref","DOI":"10.1016\/j.envres.2019.108982","article-title":"Computational evaluation of interactions between organophosphate esters and nuclear hormone receptors","volume":"182","author":"Wang","year":"2020","journal-title":"Environ. Res."},{"key":"10.1016\/j.ecoenv.2021.112086_bib71","doi-asserted-by":"crossref","first-page":"2","DOI":"10.1016\/j.mce.2005.02.007","article-title":"Endocrine disrupters: a human risk?","volume":"244","author":"Waring","year":"2005","journal-title":"Mol. Cell. Endocrinol."},{"key":"10.1016\/j.ecoenv.2021.112086_bib72","doi-asserted-by":"crossref","DOI":"10.1016\/j.mce.2019.110680","article-title":"Mechanisms of action of agrochemicals acting as endocrine disrupting chemicals","volume":"502","author":"Warner","year":"2020","journal-title":"Mol. Cell. Endocrinol."},{"key":"10.1016\/j.ecoenv.2021.112086_bib73","doi-asserted-by":"crossref","first-page":"1876","DOI":"10.1002\/pro.3496","article-title":"The nuclear receptor superfamily: a structural perspective","volume":"27","author":"Weikum","year":"2018","journal-title":"Protein Sci."},{"key":"10.1016\/j.ecoenv.2021.112086_bib74","first-page":"103","article-title":"Androgen receptor structure and function","volume":"vol. 1","author":"Wilson","year":"2003"},{"key":"10.1016\/j.ecoenv.2021.112086_bib75","doi-asserted-by":"crossref","first-page":"88","DOI":"10.1002\/(SICI)1097-0045(1996)6+<88::AID-PROS17>3.0.CO;2-N","article-title":"Role of dihydrotestosterone in androgen action","volume":"6","author":"Wilson","year":"1996","journal-title":"Prostate Suppl."},{"issue":"8","key":"10.1016\/j.ecoenv.2021.112086_bib76","doi-asserted-by":"crossref","first-page":"1665","DOI":"10.1210\/me.2010-0138","article-title":"The androgen receptor modulates expression of genes with critical roles in muscle development and function","volume":"24","author":"Wyce","year":"2010","journal-title":"Mol. Endocrinol."},{"key":"10.1016\/j.ecoenv.2021.112086_bib77","doi-asserted-by":"crossref","first-page":"26","DOI":"10.1016\/j.mce.2006.06.009","article-title":"4-Hydroxy-PCB 106 acts as a direct thyroid hormone receptor agonist in rat GH3 cells","volume":"257","author":"You","year":"2006","journal-title":"Mol. Cell. Endocrinol."}],"container-title":["Ecotoxicology and Environmental Safety"],"original-title":[],"language":"en","link":[{"URL":"https:\/\/api.elsevier.com\/content\/article\/PII:S0147651321001974?httpAccept=text\/xml","content-type":"text\/xml","content-version":"vor","intended-application":"text-mining"},{"URL":"https:\/\/api.elsevier.com\/content\/article\/PII:S0147651321001974?httpAccept=text\/plain","content-type":"text\/plain","content-version":"vor","intended-application":"text-mining"}],"deposited":{"date-parts":[[2025,9,27]],"date-time":"2025-09-27T05:27:18Z","timestamp":1758950838000},"score":1,"resource":{"primary":{"URL":"https:\/\/linkinghub.elsevier.com\/retrieve\/pii\/S0147651321001974"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[2021,5]]},"references-count":77,"alternative-id":["S0147651321001974"],"URL":"https:\/\/doi.org\/10.1016\/j.ecoenv.2021.112086","relation":{},"ISSN":["0147-6513"],"issn-type":[{"value":"0147-6513","type":"print"}],"subject":[],"published":{"date-parts":[[2021,5]]},"assertion":[{"value":"Elsevier","name":"publisher","label":"This article is maintained by"},{"value":"A computational insight into endocrine disruption by polychlorinated biphenyls via non-covalent interactions with human nuclear receptors","name":"articletitle","label":"Article Title"},{"value":"Ecotoxicology and Environmental Safety","name":"journaltitle","label":"Journal Title"},{"value":"https:\/\/doi.org\/10.1016\/j.ecoenv.2021.112086","name":"articlelink","label":"CrossRef DOI link to publisher maintained version"},{"value":"article","name":"content_type","label":"Content Type"},{"value":"\u00a9 2021 The Authors. Published by Elsevier Inc.","name":"copyright","label":"Copyright"}],"article-number":"112086"}}