{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2025,10,18]],"date-time":"2025-10-18T10:29:10Z","timestamp":1760783350653},"reference-count":40,"publisher":"American Chemical Society (ACS)","issue":"2","content-domain":{"domain":[],"crossmark-restriction":false},"short-container-title":["J. Chem. Inf. Model."],"published-print":{"date-parts":[[2011,2,28]]},"DOI":"10.1021\/ci100401t","type":"journal-article","created":{"date-parts":[[2010,12,31]],"date-time":"2010-12-31T16:12:35Z","timestamp":1293811955000},"page":"306-314","source":"Crossref","is-referenced-by-count":7,"title":["Conformational Enantiomerization and Estrogen Receptor \u03b1 Binding of Anti-Cancer Drug Tamoxifen and Its Derivatives"],"prefix":"10.1021","volume":"51","author":[{"given":"Li","family":"Gao","sequence":"first","affiliation":[{"name":"\u00d6rebro Life Science Center, School of Science and Technology, \u00d6rebro University, 70182 \u00d6rebro, Sweden"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"Yaoquan","family":"Tu","sequence":"additional","affiliation":[{"name":"\u00d6rebro Life Science Center, School of Science and Technology, \u00d6rebro University, 70182 \u00d6rebro, Sweden"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"Pia","family":"Wegman","sequence":"additional","affiliation":[{"name":"Department of Health and Medical Sciences, \u00d6rebro University, 70182 \u00d6rebro, Sweden"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"Sten","family":"Wingren","sequence":"additional","affiliation":[{"name":"Department of Health and Medical Sciences, \u00d6rebro University, 70182 \u00d6rebro, Sweden"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"Leif A.","family":"Eriksson","sequence":"additional","affiliation":[{"name":"\u00d6rebro Life Science Center, School of Science and Technology, \u00d6rebro University, 70182 \u00d6rebro, Sweden"},{"name":"School of Chemistry, National University of Ireland, Galway, Ireland"}],"role":[{"role":"author","vocabulary":"crossref"}]}],"member":"316","published-online":{"date-parts":[[2010,12,31]]},"reference":[{"key":"ref1\/cit1","doi-asserted-by":"crossref","first-page":"16","DOI":"10.1056\/NEJM198101013040104","volume":"304","author":"Ingle J. N.","year":"1981","journal-title":"N. Engl. J. Med."},{"key":"ref2\/cit2","doi-asserted-by":"crossref","first-page":"127","DOI":"10.1016\/0163-7258(84)90043-3","volume":"25","author":"Furr B. J.","year":"1984","journal-title":"Pharmacol. Ther."},{"key":"ref3\/cit3","doi-asserted-by":"crossref","first-page":"1451","DOI":"10.1016\/S0140-6736(05)79032-2","volume":"351","author":"Clarke M.","year":"1998","journal-title":"Lancet"},{"key":"ref4\/cit4","doi-asserted-by":"crossref","first-page":"927","DOI":"10.1016\/S0092-8674(00)81717-1","volume":"95","author":"Shiau A. K.","year":"1998","journal-title":"Cell"},{"key":"ref5\/cit5","doi-asserted-by":"crossref","first-page":"30","DOI":"10.1093\/jnci\/dji005","volume":"97","author":"Jin Y.","year":"2005","journal-title":"J. Natl. Cancer Inst."},{"key":"ref6\/cit6","doi-asserted-by":"crossref","first-page":"1062","DOI":"10.1124\/jpet.104.065607","volume":"310","author":"Desta Z.","year":"2004","journal-title":"J. Pharmacol. Exp. Ther."},{"key":"ref7\/cit7","doi-asserted-by":"crossref","first-page":"381","DOI":"10.1002\/bdd.2510020407","volume":"2","author":"Fabian C.","year":"1981","journal-title":"Biopharm. Drug Dispos."},{"key":"ref8\/cit8","doi-asserted-by":"crossref","first-page":"151","DOI":"10.1023\/B:BREA.0000025406.31193.e8","volume":"85","author":"Johnson M. D.","year":"2004","journal-title":"Breast Cancer Res. Treat."},{"key":"ref9\/cit9","doi-asserted-by":"crossref","first-page":"3070","DOI":"10.1107\/S0567740879011407","volume":"35","author":"Precigoux G.","year":"1979","journal-title":"Acta Crystallogr., Sect. B: Struct. Sci."},{"key":"ref10\/cit10","doi-asserted-by":"crossref","first-page":"477","DOI":"10.1021\/ja00315a003","volume":"106","author":"Biali S. E.","year":"1984","journal-title":"J. Am. Chem. Soc."},{"key":"ref11\/cit11","doi-asserted-by":"crossref","first-page":"1701","DOI":"10.1021\/ja00292a041","volume":"107","author":"Kaftory M.","year":"1985","journal-title":"J. Am. Chem. Soc."},{"key":"ref12\/cit12","doi-asserted-by":"crossref","first-page":"307","DOI":"10.1021\/ar960216z","volume":"30","author":"Rappoport Z.","year":"1997","journal-title":"Acc. Chem. Res."},{"key":"ref13\/cit13","doi-asserted-by":"crossref","first-page":"2877","DOI":"10.1021\/jm960255g","volume":"39","author":"Kuramochi H.","year":"1996","journal-title":"J. Med. Chem."},{"key":"ref14\/cit14","doi-asserted-by":"crossref","first-page":"869","DOI":"10.1039\/a707906k","author":"Schmittel M.","year":"1998","journal-title":"J. Chem. Soc., Perkin Trans. 2"},{"key":"ref15\/cit15","doi-asserted-by":"crossref","first-page":"8840","DOI":"10.1021\/jo9910435","volume":"64","author":"Rochlin E.","year":"1999","journal-title":"J. Org. Chem."},{"key":"ref16\/cit16","doi-asserted-by":"crossref","first-page":"4959","DOI":"10.1021\/jo00281a047","volume":"54","author":"Biali S. E.","year":"1989","journal-title":"J. Org. Chem."},{"key":"ref17\/cit17","doi-asserted-by":"crossref","first-page":"3857","DOI":"10.1021\/jo00093a018","volume":"59","author":"Rochlin E.","year":"1994","journal-title":"J. Org. Chem."},{"key":"ref18\/cit18","doi-asserted-by":"crossref","first-page":"2245","DOI":"10.1021\/jo00362a016","volume":"51","author":"Biali S. E.","year":"1986","journal-title":"J. Org. Chem."},{"key":"ref19\/cit19","doi-asserted-by":"crossref","first-page":"2053","DOI":"10.1021\/jm00160a044","volume":"29","author":"McCague R.","year":"1986","journal-title":"J. Med. Chem."},{"key":"ref20\/cit20","doi-asserted-by":"crossref","first-page":"5648","DOI":"10.1063\/1.464913","volume":"98","author":"Becke A. D.","year":"1993","journal-title":"J. Chem. Phys."},{"key":"ref21\/cit21","doi-asserted-by":"crossref","first-page":"785","DOI":"10.1103\/PhysRevB.37.785","volume":"37","author":"Lee C. T.","year":"1988","journal-title":"Phys. Rev. B"},{"key":"ref22\/cit22","doi-asserted-by":"crossref","first-page":"11623","DOI":"10.1021\/j100096a001","volume":"98","author":"Stephens P. J.","year":"1994","journal-title":"J. Phys. Chem."},{"key":"ref23\/cit23","doi-asserted-by":"crossref","first-page":"6378","DOI":"10.1021\/jp810292n","volume":"113","author":"Marenich A. V.","year":"2009","journal-title":"J. Phys. Chem. B"},{"key":"ref24\/cit24","unstructured":"Frisch, M. J.; Trucks, G. W.; Schlegel, H. B.; Scuseria, G. E.; Robb, M. A.; Cheeseman, J. R.; Scalmani, G.; Barone, V.; Mennucci, B.; Petersson, G. A.; Nakatsuji, H.; Caricato, M.; Li, X.; Hratchian, H. P.; Izmaylov, A. F.; Bloino, J.; Zheng, G.; Sonnenberg, J. L.; Hada, M.; Ehara, M.; Toyota, K.; Fukuda, R.; Hasegawa, J.; Ishida, M.; Nakajima, T.; Honda, Y.; Kitao, O.; Nakai, H.; Vreven, T.; Montgomery, J. A., Jr.; Peralta, J. E.; Ogliaro, F.; Bearpark, M.; Heyd, J. J.; Brothers, E.; Kudin, K. N.; Staroverov, V. N.; Kobayashi, R.; Normand, J.; Raghavachari, K.; Rendell, A.; Burant, J. C.; Iyengar, S. S.; Tomasi, J.; Cossi, M.; Rega, N.; Millam, J. M.; Klene, M.; Knox, J. E.; Cross, J. B.; Bakken, V.; Adamo, C.; Jaramillo, J.; Gomperts, R.; Stratmann, R. E.; Yazyev, O.; Austin, A. J.; Cammi, R.; Pomelli, C.; Ochterski, J. W.; Martin, R. L.; Morokuma, K.; Zakrzewski, V. G.; Voth, G. A.; Salvador, P.; Dannenberg, J. J.; Dapprich, S.; Daniels, A. D.; Farkas, O.; Foresman, J. B.; Ortiz, J. V.; Cioslowski, J.; Fox, D. J.Gaussian 09, Revision A.02;Gaussian, Inc.:Wallingford CT, 2009."},{"key":"ref25\/cit25","doi-asserted-by":"crossref","first-page":"1460","DOI":"10.1021\/ct800182e","volume":"4","author":"Johansson M. P.","year":"2008","journal-title":"J. Chem. Theory Comput."},{"key":"ref26\/cit26","volume-title":"Molecular Operating Enviroment (MOE)","year":"2009"},{"key":"ref27\/cit27","doi-asserted-by":"crossref","first-page":"678","DOI":"10.1002\/prot.20251","volume":"57","author":"Krieger E.","year":"2004","journal-title":"Proteins: Struct., Funct., Bioinf."},{"key":"ref28\/cit28","doi-asserted-by":"crossref","first-page":"1999","DOI":"10.1002\/jcc.10349","volume":"24","author":"Duan Y.","year":"2003","journal-title":"J. Comput. Chem."},{"key":"ref29\/cit29","doi-asserted-by":"crossref","first-page":"1623","DOI":"10.1002\/jcc.10128","volume":"23","author":"Jakalian A.","year":"2002","journal-title":"J. Comput. Chem."},{"key":"ref30\/cit30","doi-asserted-by":"crossref","first-page":"374","DOI":"10.1002\/qua.10731","volume":"96","author":"Huang M. J.","year":"2004","journal-title":"Int. J. Quantum Chem."},{"key":"ref31\/cit31","doi-asserted-by":"crossref","first-page":"4078","DOI":"10.1021\/jo060098l","volume":"71","author":"Bren U.","year":"2006","journal-title":"J. Org. Chem."},{"key":"ref32\/cit32","doi-asserted-by":"crossref","first-page":"1134","DOI":"10.1021\/tx700073d","volume":"20","author":"Bren U.","year":"2007","journal-title":"Chem. Res. Toxicol."},{"key":"ref33\/cit33","doi-asserted-by":"crossref","first-page":"8720","DOI":"10.1021\/jf800965y","volume":"56","author":"Galesa K.","year":"2008","journal-title":"J. Agric. Food Chem."},{"key":"ref34\/cit34","doi-asserted-by":"crossref","first-page":"10449","DOI":"10.1074\/jbc.M611424200","volume":"282","author":"Heldring N.","year":"2007","journal-title":"J. Biol. Chem."},{"key":"ref35\/cit35","doi-asserted-by":"crossref","first-page":"3593","DOI":"10.1073\/pnas.0407189102","volume":"102","author":"Kong E. H.","year":"2005","journal-title":"Proc. Natl. Acad. Sci. U. S. A."},{"key":"ref36\/cit36","doi-asserted-by":"crossref","first-page":"1589","DOI":"10.1021\/jm0204800","volume":"46","author":"Muthyala R. S.","year":"2003","journal-title":"J. Med. Chem."},{"key":"ref37\/cit37","doi-asserted-by":"crossref","first-page":"753","DOI":"10.1038\/39645","volume":"389","author":"Brzozowski A. M.","year":"1997","journal-title":"Nature"},{"key":"ref38\/cit38","doi-asserted-by":"crossref","first-page":"413","DOI":"10.1016\/j.molcel.2005.04.014","volume":"18","author":"Wu Y. L.","year":"2005","journal-title":"Mol. Cell"},{"key":"ref39\/cit39","doi-asserted-by":"crossref","first-page":"897","DOI":"10.1110\/ps.062729207","volume":"16","author":"Vajdos F. F.","year":"2007","journal-title":"Protein Sci."},{"key":"ref40\/cit40","doi-asserted-by":"crossref","first-page":"2171","DOI":"10.1021\/jm034243o","volume":"47","author":"Kim S.","year":"2004","journal-title":"J. Med. Chem."}],"container-title":["Journal of Chemical Information and Modeling"],"original-title":[],"language":"en","link":[{"URL":"https:\/\/pubs.acs.org\/doi\/pdf\/10.1021\/ci100401t","content-type":"unspecified","content-version":"vor","intended-application":"similarity-checking"}],"deposited":{"date-parts":[[2023,4,6]],"date-time":"2023-04-06T01:46:27Z","timestamp":1680745587000},"score":1,"resource":{"primary":{"URL":"https:\/\/pubs.acs.org\/doi\/10.1021\/ci100401t"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[2010,12,31]]},"references-count":40,"journal-issue":{"issue":"2","published-print":{"date-parts":[[2011,2,28]]}},"alternative-id":["10.1021\/ci100401t"],"URL":"https:\/\/doi.org\/10.1021\/ci100401t","relation":{},"ISSN":["1549-9596","1549-960X"],"issn-type":[{"value":"1549-9596","type":"print"},{"value":"1549-960X","type":"electronic"}],"subject":[],"published":{"date-parts":[[2010,12,31]]}}}