Structural properties of liquid N-methylacetamide via ab initio, path integral, and classical molecular dynamics
- T.W. Whitfield
- J. Crain
- et al.
- 2006
- Journal of Chemical Physics
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Is Poisson-Boltzmann theory insufficient for protein folding simulations?
- Thu Zar Lwin
- Ruhong Zhou
- et al.
- 2006
- Journal of Chemical Physics
Characterization of the TIP4P-Ew water model: Vapor pressure and boiling point
- Hans W. Horn
- William C. Swope
- et al.
- 2005
- Journal of Chemical Physics
Molecular dynamics investigation of dynamical properties of phosphatidylethanolamine lipid bilayers
- Michael C. Pitman
- Frank Suits
- et al.
- 2005
- Journal of Chemical Physics
Molecular dynamics investigation of the structural properties of phosphatidylethanolamine lipid bilayers
- Frank Suits
- Michael C. Pitman
- et al.
- 2005
- Journal of Chemical Physics
Segregation in aqueous methanol enhanced by cooling and compression
- L. Dougan
- R. Hargreaves
- et al.
- 2005
- Journal of Chemical Physics
Calculation of nonadiabatic couplings in density-functional theory
- Salomon R. Billeter
- Alessandro Curioni
- 2004
- Journal of Chemical Physics
Long range interactions on wires: A reciprocal space based formalism
- Peter Mináry
- Joseph A. Morrone
- et al.
- 2004
- Journal of Chemical Physics
Methanol-water solutions: A bi-percolating liquid mixture
- L. Dougan
- S.P. Bates
- et al.
- 2004
- Journal of Chemical Physics
Development of an improved four-site water model for biomolecular simulations: TIP4P-Ew
- Hans W. Horn
- William C. Swope
- et al.
- 2004
- Journal of Chemical Physics