J. Gao

All-atom empirical potential for molecular modeling and dynamics studies of proteins.

Alexander D. MacKerell, M. Karplus, D. Nguyen, 1998, The journal of physical chemistry. B.

Hidden thermodynamics of mutant proteins: a molecular dynamics analysis.

M. Karplus, B. Tidor, J. Gao, 1989, Science.

A priori evaluation of aqueous polarization effects through Monte Carlo QM-MM simulations.

J. Gao, Jiali Gao, X. Xia, 1992, Science.

Aroyleneimidazophenazine: A Sensitive Probe for Detecting CN− Anion and its Solvatochromism Effect

Say Chye Joachim Loo, J. Gao, S. C. Loo, 2015 .

Triterpene and diterpene inhibitors of pyruvate dehydrogenase kinase (PDK).

J. Gao, S. S. Shetty, T. Aicher, 1999, Bioorganic & medicinal chemistry letters.

Substituted tetrahydropyrrolo[2,1-b]oxazol-5(6H)-ones and tetrahydropyrrolo[2,1-b]thiazol-5(6H)-ones as hypoglycemic agents.

J. Gao, R. Simpson, R. Deems, 1998, Journal of medicinal chemistry.

The nature of cation-pi binding: interactions between tetramethylammonium ion and benzene in aqueous solution.

J. Gao, A. Auerbach, L. Chou, 1993, Biophysical journal.