题 目： Computer Aided Drug Design (CADD) targeting Virus, Cancers and Signal Transduction Pathways
报告人： Chun Wu 副教授（Rowan University）
时 间： 7月2日（周一）14:00
地 点：药学院351会议室
主持人：侯廷军 教授
Homology modeling, molecular docking and molecular dynamics (MD) simulations are powerful computational tools to gain insights on how drugs work and thus enable us to do rational drug design. Using these computational tools, a large number of CADD projects have been carried out in my labs. In this talk, several examples will be discussed: 1). Developing novel anti-virus drug against herpes simplex virus type I (HSV-1) entry using virtual screening. 2). Probing the binding of anticancer ligands to DNA/RNA G-quadruples using all-atom free ligand binding MD simulations. 3.) Probing the activation mechanism GPCR (Adreno-, Dopamine-, Opioid-, etc.) receptors using MD simulations with explicit membrane.
主办：浙江大学药学院
承办：浙江大学药物代谢和药物分析研究所
