Format
Sort by

Send to

Choose Destination

Links from PubMed

Items: 1 to 20 of 124

1.

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;92(7):795-802. doi: 10.1016/j.chemosphere.2013.04.022.

PMID:
23664479
2.

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;92:258-64. doi: 10.1016/j.ecoenv.2013.03.008.

PMID:
23582771
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. doi: 10.1016/j.scitotenv.2012.08.072.

PMID:
23137989
4.

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;65(3):357-67. doi: 10.1007/s00244-013-9916-2.

PMID:
23712771
5.

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):626-35. doi: 10.1016/j.etap.2013.06.004.

PMID:
23850706
6.

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;27(2):87-99. doi: 10.1080/1062936X.2015.1134653.

PMID:
26848875
7.

Anti-androgen activity of polybrominated diphenyl ethers determined by comparative molecular similarity indices and molecular docking.

Yang W, Mu Y, Giesy JP, Zhang A, Yu H.

Chemosphere. 2009 May;75(9):1159-64. doi: 10.1016/j.chemosphere.2009.02.047.

PMID:
19324393
8.

Combined 3D-QSAR, molecular docking and molecular dynamics study on thyroid hormone activity of hydroxylated polybrominated diphenyl ethers to thyroid receptors β.

Li X, Ye L, Wang X, Wang X, Liu H, Zhu Y, Yu H.

Toxicol Appl Pharmacol. 2012 Dec 15;265(3):300-7. doi: 10.1016/j.taap.2012.08.030.

PMID:
22982074
9.

Molecular dynamics simulation, free energy calculation and structure-based 3D-QSAR studies of B-RAF kinase inhibitors.

Yang Y, Qin J, Liu H, Yao X.

J Chem Inf Model. 2011 Mar 28;51(3):680-92. doi: 10.1021/ci100427j.

PMID:
21338122
10.
11.

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 1;12(23):6193-208.

PMID:
15519163
12.
13.

Detection of persistent organic pollutants binding modes with androgen receptor ligand binding domain by docking and molecular dynamics.

Xu XJ, Su JG, Bizzarri AR, Cannistraro S, Liu M, Zeng Y, Chen WZ, Wang CX.

BMC Struct Biol. 2013 Sep 22;13:16. doi: 10.1186/1472-6807-13-16.

14.

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;32(3):478-85. doi: 10.1016/j.etap.2011.09.001.

PMID:
22004969
15.

Studies of N(9)-arenthenyl purines as novel DFG-in and DFG-out dual Src/Abl inhibitors using 3D-QSAR, docking and molecular dynamics simulations.

Ma S, Zeng G, Fang D, Wang J, Wu W, Xie W, Tan S, Zheng K.

Mol Biosyst. 2015 Feb;11(2):394-406. doi: 10.1039/c4mb00350k.

PMID:
25406390
16.

Prediction of octanol-air partition coefficients for polychlorinated biphenyls (PCBs) using 3D-QSAR models.

Chen Y, Cai X, Jiang L, Li Y.

Ecotoxicol Environ Saf. 2016 Feb;124:202-12. doi: 10.1016/j.ecoenv.2015.10.024.

PMID:
26524653
17.
19.
20.

Studies of H4R antagonists using 3D-QSAR, molecular docking and molecular dynamics.

Liu J, Li Y, Zhang HX, Zhang SW, Yang L.

J Mol Model. 2012 Mar;18(3):991-1001. doi: 10.1007/s00894-011-1137-x.

PMID:
21647664
Items per page

Supplemental Content

Support Center