Molecular Mechanisms and Structural Basis of Retigabine Analogues in Regulating KCNQ2 Channel - Shi, Sai; Li, Junwei; Sun, Fude; Chen, Yafei; Pang, Chunli; Geng, Yizhao; Qi, Jinlong; Guo, Shuai; Wang, Xuzhao; Zhang, Hailin; Zhan, Yong; An, Hailong (The Journal of membrane biology, 2020)
Keywords: Amino Acid Sequence; Binding; Binding Sites; Biochemistry; Biomedical and Life Sciences; Carbamates - pharmacology; Clinical trials; Design optimization; Epilepsy; Excitability; Human Physiology; Hydrogen Bonding; Hydrogen bonds; Hydrophobicity; Ion Channel Gating - drug effects; KCNQ2 Potassium Channel - chemistry; KCNQ2 Potassium Channel - physiology; KCNQ2 protein; Life Sciences; Membrane Transport Modulators - pharmacology; Molecular Docking Simulation; Molecular Dynamics Simulation; Molecular modelling; Neuralgia; Phenylenediamines - pharmacology; Potassium channels (voltage-gated); Protein Binding; Protein Conformation; Structure-Activity Relationship; Therapeutic targets; Retigabine; Ion channel; Epilepsy; KCNQ2; Molecular simulations