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- Computational insights into different inhibition modes of the κ-opioid receptor with antagonists LY2456302 and JDTic. Jianxin Cheng, Weihua Li, Guixia Liu, Weiliang Zhu, Yun Tang
, RSC Adv.
, 2016
, 6
, 13626
- Synthesis and pharmacological evaluation of enantiomerically pure endo-configured KOR agonists with 2-azabicyclo[3.2.1]octane scaffold. Hendrik Jonas, Daniele Aiello, Bastian Frehland, Kirstin Lehmkuhl, Dirk Schepmann, Jens Köhler, Patrizia Diana, Bernhard Wünsch
, Org. Biomol. Chem.
, 2021
, 19
, 8384
- Stereoselective synthesis of conformationally restricted KOR agonists based on the 2,5-diazabicyclo[2.2.2]octane scaffold. Christian Wittig, Dirk Schepmann, Michael Soeberdt, Constantin G. Daniliuc, Bernhard Wünsch
, Org. Biomol. Chem.
, 2017
, 15
, 6520
- Insights into a defined secondary binding region on β-adrenoceptors and putative roles in ligand binding and drug design. M. A. Soriano-Ursúa, J. G. Trujillo-Ferrara, J. A. Arias-Montaño, R. Villalobos-Molina
, Med. Chem. Commun.
, 2015
, 6
, 991
- Diversity-oriented synthesis of medicinally important 1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid (Tic) derivatives and higher analogs. Sambasivarao Kotha, Deepak Deodhar, Priti Khedkar
, Org. Biomol. Chem.
, 2014
, 12
, 9054
- Probing the cooperative mechanism of the μ–δ opioid receptor heterodimer by multiscale simulation. Longrong Wang, Yuan Yuan, Xin Chen, Jiangfan Chen, Yanzhi Guo, Menglong Li, Chuan Li, Xuemei Pu
, Phys. Chem. Chem. Phys.
, 2018
, 20
, 29969
- Incorporating QM and solvation into docking for applications to GPCR targets. Minsup Kim, Art E. Cho
, Phys. Chem. Chem. Phys.
, 2016
, 18
, 28281