Toan B. Nguyen

Monte Carlo simulations of pure liquid substituted benzenes with OPLS potential functions

William L. Jorgensen, Ellen R. Laird, Toan B. Nguyen et al. · Journal of Computational Chemistry · 1993 · 179 citations

Natural Sciences, Chemistry, Physics +13

Monte Carlo simulations of the hydration of substituted benzenes with OPLS potential functions

William L. Jorgensen, Toan B. Nguyen · Journal of Computational Chemistry · 1993 · 172 citations

Natural Sciences, Chemistry, Physics +17

Monte Carlo simulations of liquid acetic acid and methyl acetate with the OPLS potential functions

James M. Briggs, Toan B. Nguyen, William L. Jorgensen · The Journal of Physical Chemistry · 1991 · 157 citations

Natural Sciences, Chemistry, Computational Chemistry +9

Accuracy of free energies of hydration for organic molecules from 6‐31g*‐derived partial charges

Heather A. Carlson, Toan B. Nguyen, Modesto Orozco et al. · Journal of Computational Chemistry · 1993 · 154 citations

Natural Sciences, Chemistry, Physics +17

Pyrrolopyrimidine inhibitors of DNA gyrase B (GyrB) and topoisomerase IV (ParE). Part I: Structure guided discovery and optimization of dual targeting agents with potent, broad-spectrum enzymatic activity

Leslie W. Tari, Michael Trzoss, Daniel C. Bensen et al. · Bioorganic & Medicinal Chemistry Letters · 2012 · 118 citations

Pharmacy, Medicinal Chemistry, Pharmacology +14