Applied Mathematics and Numerical Analysis | |||
| Session 695 - Numerical Methods for Molecular and Mesoscopic Systems | |||
| This session will address advances in numerical simulation methods for molecular- and mesoscopic-scale modeling of complex systems. Numerical methods of interest span a broad spectrum and include stochastic simulation methods such as kinetic Monte Carlo and Brownian dynamics, methods for analysis of rare-event dynamics, coarse time-stepper-based methods for nonlinear analysis of dynamical systems such as coarse molecular dynamics, methods for statistical analysis of microscopic simulations, and optimization methods. | |||
| Chair: | Dimitrios Maroudas | ||
| CoChair: | Dmitry I. Kopelevich | ||
| CoSponsor(s): | Computational Molecular Science and Engineering Forum Engineering Sciences and Fundamentals | ||
| 695a | Coarse MD Exploration of Effective Free Energy Landscape for Alanine-Dipeptide in Water Thomas A. Frewen, Yannis G. Kevrekidis, Gerhard Hummer | ||
| 695b | Hybrid, Multiscale Algorithm for Simulating Stochastic Systems Asawari Samant, Dionisios G. Vlachos, Babatunde A. Ogunnaike | ||
| 695c | Diffusion Monte-Carlo without All the Hops Tomas Oppelstrup, Vasily V. Bulatov, George H. Gilmer, Malvin H. Kalos, Babak Sadigh | ||
| 695d | Application of the Dissipative Particle Dynamics Method to Ferromagnetic Colloidal Dispersions Akira Satoh, Roy W. Chantrell | ||
| 695e | Karhunen-Loeve Analysis for Pattern Description in Phase Separated Lipid Bilayer Systems Roland Faller, Jeff Switzer, Sandra V. Bennun, Margie Longo, A. Palazoglu | ||
| 695f | Markovian Analysis and Simulation of the Formation of Carbon Adsorbents: Non-Linear Modeling A. Argoti, L. T. Fan, W. P. Walawender, S. T. Chou | ||
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