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Journal Abstract Search

180 related items for PubMed ID: 23850706

  • 1. Molecular docking, molecular dynamics simulation, and structure-based 3D-QSAR studies on the aryl hydrocarbon receptor agonistic activity of hydroxylated polychlorinated biphenyls.
    Cao F, Li X, Ye L, Xie Y, Wang X, Shi W, Qian X, Zhu Y, Yu H.
    Environ Toxicol Pharmacol; 2013 Sep; 36(2):626-635. PubMed ID: 23850706
    [Abstract] [Full Text] [Related]

  • 2. Molecular docking and 3D-QSAR studies on the glucocorticoid receptor antagonistic activity of hydroxylated polychlorinated biphenyls.
    Liu S, Luo Y, Fu J, Zhou J, Kyzas GZ.
    SAR QSAR Environ Res; 2016 Sep; 27(2):87-99. PubMed ID: 26848875
    [Abstract] [Full Text] [Related]

  • 3. Molecular docking, molecular dynamics simulation, and structure-based 3D-QSAR studies on estrogenic activity of hydroxylated polychlorinated biphenyls.
    Li X, Ye L, Wang X, Wang X, Liu H, Qian X, Zhu Y, Yu H.
    Sci Total Environ; 2012 Dec 15; 441():230-8. PubMed ID: 23137989
    [Abstract] [Full Text] [Related]

  • 4. Docking and 3D-QSAR studies on the Ah receptor binding affinities of polychlorinated biphenyls (PCBs), dibenzo-p-dioxins (PCDDs) and dibenzofurans (PCDFs).
    Li F, Li X, Liu X, Zhang L, You L, Zhao J, Wu H.
    Environ Toxicol Pharmacol; 2011 Nov 15; 32(3):478-85. PubMed ID: 22004969
    [Abstract] [Full Text] [Related]

  • 5. Docking-based three-dimensional quantitative structure-activity relationship (3D-QSAR) predicts binding affinities to aryl hydrocarbon receptor for polychlorinated dibenzodioxins, dibenzofurans, and biphenyls.
    Yuan J, Pu Y, Yin L.
    Environ Toxicol Chem; 2013 Jul 15; 32(7):1453-8. PubMed ID: 23424013
    [Abstract] [Full Text] [Related]

  • 6. In silico exploration of hydroxylated polychlorinated biphenyls as estrogen receptor β ligands by 3D-QSAR, molecular docking and molecular dynamics simulations.
    Wang F, Qiu Y, Zhou B.
    J Biomol Struct Dyn; 2022 Sep 15; 40(15):6798-6809. PubMed ID: 33645467
    [Abstract] [Full Text] [Related]

  • 7. In silico study on hydroxylated polychlorinated biphenyls as androgen receptor antagonists.
    Li X, Ye L, Shi W, Liu H, Liu C, Qian X, Zhu Y, Yu H.
    Ecotoxicol Environ Saf; 2013 Jun 15; 92():258-64. PubMed ID: 23582771
    [Abstract] [Full Text] [Related]

  • 8. Prediction of binding affinities of PCDDs, PCDFs and PCBs using docking-based Comparative Molecular Similarity Indices Analysis.
    Yuan J, Pu Y, Yin L.
    Environ Toxicol Pharmacol; 2014 Jul 15; 38(1):1-7. PubMed ID: 24858058
    [Abstract] [Full Text] [Related]

  • 9. Molecular modeling and molecular dynamics simulation studies on the interactions of hydroxylated polychlorinated biphenyls with estrogen receptor-β.
    Li X, Ye L, Wang X, Shi W, Qian X, Zhu Y, Yu H.
    Arch Environ Contam Toxicol; 2013 Oct 15; 65(3):357-67. PubMed ID: 23712771
    [Abstract] [Full Text] [Related]

  • 10. Comprehensive binding analysis of polybrominated diphenyl ethers and aryl hydrocarbon receptor via an integrated molecular modeling approach.
    Xiao H, Mei N, Chi Q, Wang X.
    Chemosphere; 2021 Jan 15; 262():128356. PubMed ID: 33182092
    [Abstract] [Full Text] [Related]

  • 11. In silico investigations of anti-androgen activity of polychlorinated biphenyls.
    Li X, Ye L, Wang X, Shi W, Liu H, Qian X, Zhu Y, Yu H.
    Chemosphere; 2013 Aug 15; 92(7):795-802. PubMed ID: 23664479
    [Abstract] [Full Text] [Related]

  • 12. Analysis of Ah receptor binding affinities of polybrominated diphenyl ethers via in silico molecular docking and 3D-QSAR.
    Li X, Wang X, Shi W, Liu H, Yu H.
    SAR QSAR Environ Res; 2013 Jan 15; 24(1):75-87. PubMed ID: 23121134
    [Abstract] [Full Text] [Related]

  • 13. Mono-hydroxylated polychlorinated biphenyls are potent aryl hydrocarbon receptor ligands in recombinant yeast cells.
    Kamata R, Shiraishi F, Nakajima D, Takigami H, Shiraishi H.
    Toxicol In Vitro; 2009 Jun 15; 23(4):736-43. PubMed ID: 19327395
    [Abstract] [Full Text] [Related]

  • 14. In silico predictive studies of mAHR congener binding using homology modelling and molecular docking.
    Panda R, Cleave AS, Suresh PK.
    Toxicol Ind Health; 2014 Sep 15; 30(8):765-76. PubMed ID: 23081860
    [Abstract] [Full Text] [Related]

  • 15. Models of polychlorinated dibenzodioxins, dibenzofurans, and biphenyls binding affinity to the aryl hydrocarbon receptor developed using (13)c NMR data.
    Beger RD, Wilkes JG.
    J Chem Inf Comput Sci; 2001 Sep 15; 41(5):1322-9. PubMed ID: 11604033
    [Abstract] [Full Text] [Related]

  • 16. Insight into the interaction mechanism of human SGLT2 with its inhibitors: 3D-QSAR studies, homology modeling, and molecular docking and molecular dynamics simulations.
    Dong L, Feng R, Bi J, Shen S, Lu H, Zhang J.
    J Mol Model; 2018 Mar 06; 24(4):86. PubMed ID: 29511885
    [Abstract] [Full Text] [Related]

  • 17. 3D QSAR studies of hydroxylated polychlorinated biphenyls as potential xenoestrogens.
    Ruiz P, Ingale K, Wheeler JS, Mumtaz M.
    Chemosphere; 2016 Feb 06; 144():2238-46. PubMed ID: 26598992
    [Abstract] [Full Text] [Related]

  • 18. Molecular docking and 3D QSAR studies on 1-amino-2-phenyl-4-(piperidin-1-yl)-butanes based on the structural modeling of human CCR5 receptor.
    Xu Y, Liu H, Niu C, Luo C, Luo X, Shen J, Chen K, Jiang H.
    Bioorg Med Chem; 2004 Dec 01; 12(23):6193-208. PubMed ID: 15519163
    [Abstract] [Full Text] [Related]

  • 19. Combining NMR spectral and structural data to form models of polychlorinated dibenzodioxins, dibenzofurans, and biphenyls binding to the AhR.
    Beger RD, Buzatu DA, Wilkes JG.
    J Comput Aided Mol Des; 2002 Oct 01; 16(10):727-40. PubMed ID: 12650590
    [Abstract] [Full Text] [Related]

  • 20. A QSAR evaluation of Ah receptor binding of halogenated aromatic xenobiotics.
    Mekenyan OG, Veith GD, Call DJ, Ankley GT.
    Environ Health Perspect; 1996 Dec 01; 104(12):1302-10. PubMed ID: 9118871
    [Abstract] [Full Text] [Related]

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