Derivation of Fixed Partial Charges for Amino Acids Accommodating a Specific Water Model and Implicit Polarization

by Cerutti, David S., Rice, Julia E., Swope, William C., Case, David A.
Published 2013

ff14ipq: A Self-Consistent Force Field for Condensed-Phase Simulations of Proteins

by Cerutti, David S., Swope, William C., Rice, Julia E., Case, David A.
Published 2014

Alchemical prediction of hydration free energies for SAMPL

by Mobley, David L., Liu, Shaui, Cerutti, David S., Swope, William C., Rice, Julia E.
Published 2011

Identifying Molecular Structural Aromaticity for Hydrocarbon Classification

by Fortenberry, Ryan C., Novak, Carlie M., Lee, Timothy J., Bera, Partha P., Rice, Julia E.
Published in ACS Omega (2018)