Wenchao Yang

Free-energy perturbation simulation on transition states and redesign of butyrylcholinesterase.

Fang Zheng, Chang-Guo Zhan, C. Zhan, 2009, Biophysical journal.

Computational redesign of human butyrylcholinesterase for anticocaine medication.

Guangfu Yang, Chang-Guo Zhan, D. Gao, 2005, Proceedings of the National Academy of Sciences of the United States of America.

Most efficient cocaine hydrolase designed by virtual screening of transition states.

Fang Zheng, Chang-Guo Zhan, D. Gao, 2008, Journal of the American Chemical Society.

New inhibitor of 3-phosphoinositide dependent protein kinase-1 identified from virtual screening.

Chang-Guo Zhan, Adel Hamza, A. Hamza, 2012, Bioorganic & medicinal chemistry letters.

Computational design of a human butyrylcholinesterase mutant for accelerating cocaine hydrolysis based on the transition-state simulation.

Guangfu Yang, Chang-Guo Zhan, D. Gao, 2006, Angewandte Chemie.