Theoretical and Computational Chemistry

		Fernando Raineri		Adjunct Associate Professor. Solvent effects on electron transfer reactions; equilibrium and nonequilibrium solvation; thermodynamics, structure and dynamics of liquids and solutions.
		Carlos Simmerling		Associate Professor.Development of new algorithms and programs for simulation of large biomolecular systems; development of tools for the visualization and analysis of the data generated by such calculations.
		George Stell		Distinguished Professor.Molecular theory of fluids; transport and thermodynamic properties of fluids.
		Jin Wang		Assistant Professor.Theoretical biophysics and biophysical chemistry; protein folding; molecular recognition; biomolecular reaction dynamics; single molecules.