Content:
Chapter 1 Computational Techniques and Strategies for Monte Carlo Thermodynamic Calculations, with Applications to Nanoclusters (pages 1–41): Robert Q. Topper, David L. Freeman, Denise Bergin and Keirnan R. LaMarche
Chapter 2 Computing Hydrophobicity (pages 43–77): David E. Smith and A. D. J. Haymet
Chapter 3 Born–Oppenheimer Direct Dynamics Classical Trajectory Simulations (pages 79–146): Lipeng Sun and William L. Hase
Chapter 4 The Poisson–Boltzmann Equation (pages 147–365): Gene Lamm