About Me

I’m Jia-Yue Wang, Max works for me too. I’m currently a researcher at DPTechnology, immersed in the field of computer/ai-aided drug design (CADD/AIDD), leveraging expertise to pioneer innovative solutions. Previously, I served as a post-doctoral research fellow at Peking University Shenzhen Hospital fortunately to work with Prof. Xiao-chi Ma on mechanism studies of ligand-receptor interaction and designing/modifying mechanism-driven fluorescent detectors. I received my Ph.D. in Physiochemistry at Dalian Institute of Chemical Physics, Chinese Academy of Sciences, supervised by one of the Distinguished Young Scholars Prof. Keli Han. Aside from chemistry, physics and bit of computer science, my mixed background also involves biology, I obtained my bachelor’s degree in biology from Northwest A&F univeristy.

I’m dedicated to pushing the boundaries of early-stage drug design using Ligand-based strategies and implementing abstract computational chemistry theories for practical industrial applications. My passion lies in bridging theory and real-world impact, driving advancements in pharmaceutical research.

My research lies in computer/ai-aided drug design – with a special focus on early stage molecular design in the absence of reliable receptor structures. My research interests include molecular mechanics, molecular dynamics, (ab initio) molecular generation, Ligand-based-drug-design(LBDD), pseudo-receptor theory, and virtual screening.

Publications