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Molecular and Mesoscopic Systems: Methods and Applications

Tuesday, October 18, 2011: 12:30 PM
101 J (Minneapolis Convention Center)

Description:
Advances in the modeling and simulation of molecular and mesoscopic level systems are invited. Interfaces, molecular interactions, coarse graining, mesoscopic simulations and modeling, as well as multiscale approaches are among the areas that are covered by this session.


Sponsor:
Applied Mathematics and Numerical Analysis


Chair:
Gerassimos Orkoulas
Email: makis@seas.ucla.edu

Co-Chair:
Raymond A. Adomaitis
Email: adomaiti@umd.edu



12:30 PM
(317a) Application of the Path Integration Formalism to Analysis of Activated Processes In Complex Molecular Systems
Dmitry I. Kopelevich


12:55 PM
(317b) Coupling Ballistic Transport and Surface Reaction Models for Simulation of Atomic Layer Deposition Processes
Curtisha D. Travis and Raymond A. Adomaitis


1:20 PM
(317c) Substrate-Induced Oscillatory Activity of An Enzyme Regulated by Multisite Phosphorylation
Ping Liu, Ioannis G. Kevrekidis and Stanislav Y. Shvartsman


1:45 PM
(317d) Stochastic Modeling and Monte Carlo Simulation of Bacterial Disinfection: Generalized Approach
Andres Argoti, L. T. Fan, Ronaldo G. Maghirang and S. T. Chou


2:10 PM
(317e) Molecular Thermodynamics Modeling of Water Equilibrium and Heat of Sorption In Human Stratum Corneum
Victor R. Vasquez, O. Hanbury and Charles Coronella


2:35 PM
(317f) Predator-Prey Targeting In Porous Medium by Chemical Swarm Robots
Peter Grancic and Frantisek Stepanek
See more of this Group/Topical: Computing and Systems Technology Division
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