Peter J. Dyer, Ph.D.

Molecular Modeling

Peter T. Cummings	grad student	2008	Vanderbilt
(Molecular modeling of aqueous solutions: The effects of molecular polarization on classical forcefield development.)

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Docherty H, Dyer PJ, Cummings PT. (2011) The importance of polarisability in the modelling of solubility: Quantifying the effect of charged co-solutes on the solubility of small non-polar solutes Molecular Simulation. 37: 299-309
Dyer PJ, Docherty H, Cummings PT. (2008) The importance of polarizability in the modeling of solubility: quantifying the effect of solute polarizability on the solubility of small nonpolar solutes in popular models of water. The Journal of Chemical Physics. 129: 024508
Leng YS, Dyer PJ, Krstic PS, et al. (2007) Calibration of chemical bonding between benzenedithiolate and gold: The effects of geometry and size of gold clusters Molecular Physics. 105: 293-300
Dyer PJ, Cummings PT. (2006) Hydrogen bonding and induced dipole moments in water: predictions from the Gaussian charge polarizable model and Car-Parrinello molecular dynamics. The Journal of Chemical Physics. 125: 144519
Dyer PJ, Cummings PT. (2005) Solvation study using gaussian charges particles and GCPM water model Aiche Annual Meeting, Conference Proceedings. 10208