Poster Sessions

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CIMMS-IPAM Workshop Molecular Modeling and Computation: Perspectives and Challenges
November 15 - 16, 2002 (Friday and Saturday)

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Poster Presentations

The poster boards are 30" x 40", which hold about 9 letter-sized (8.5" x 11") sheets. Presenters should give a summary of their work to fit on 9 letter-sized sheets and should be prepared to discuss their work with interested parties that will be viewing the posters.

Poster sessions will take place during lunch on November 15 and 16, 2002.

Beckman Institute Auditorium
400 S. Wilson Ave,
Room 134
November 15-16, 2002

Schedule

15 NOVEMBER, FRIDAY Morning Session: Moderator, Jerrold Marsden, Caltech / CIMMS Director
11:45	POSTER SESSION AND LUNCH

	Andrew Berglund` FRET Correlation Spectroscopy and Applications to Stochastic Molecular Dynamics Harish Bhat Averaged Dynamics via Averaged Lagrangians Kumar Bobba New Methods for Reducing the Dimensions of Multiscale Fluid Dynamic Problems Alfredo Cárdenas and Ron Elber Molecular Dynamics Simulations of the Folding Kinetics of Cytochrome C: The Role of Non-Native Contacts John Chodera Extacting Dynamical Quantities from Parallel Tempering Simulations Using Reweighting Techniques Razvan Fetecau Variational collision integrators Carsten Hartmann On the Effects of Fast Degrees of Freedom on Macroscopic Dynamical Behaviour Zhidong Jia and Ben Leimkuhler A Parallel Multiple Time-Scale Reversible Integrator for Dynamics Simulation Benjamin Rahn A Parallel Multiple Time-Scale Reversible Integrator for Dynamics Simulation Wei Wang Analysis of a Few Numerical Integration Methods for the Langevin Equation Marcus Weber Characterization of Transition States in Conformational Dynamics Using Fuzzy Sets

16 NOVEMBER, SATURDAY Morning Session: Moderator, Peter Deuflhard, ZIB Director
11:45	POSTER SESSION AND LUNCH

	Danny Barash On Incorporating Multiple Timestep Methods into Particle Mesh Ewald for Biomolecular Simulations Matthew Cargo Discrete Variable Representations Using Incomplete Quadrature Formulas David Hardy Multiple Grid Method for Solving the N-Body Problem Qun Ma and Jesus Izaguirre Targeted Langevin Stabilization of Molecular Dynamics Melvin Leok A Discrete Theory of Connections on Principal Bundles Florence J. Lin Geometric Mechanics and Internal Rotation in van der Waals Complexes Qun Ma, Jesus Izaguirre, and Robert Skeel Verlet-I/r-RESPA is Limited by Non-Linear Instability Peter Minary A Novel Variable Transformation Approach for Enhancing Conformational Sampling in Complex Systems Matthias Reinsch Symbols on the Sphere Matthew West Discrete Mechanics and Variational Integrators Kim Wong Identification of Networks of Coupled Promoting Motion in Enzymatic Reactions via INM Analysis

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