Session: Beyond Standard Hardware: GPUs, Cloud Computing and Crowdsourcing (2012 Annual Meeting)

Description:

Beyond standard hardware: GPUs, cloud computing and crowdsourcing

Sponsor:

Computational Molecular Science and Engineering Forum

Chair:

Peter T. Cummings
Vanderbilt University
Chemical and Biomolecular Engineering
Nashville, TN 37235
Phone Number: 615-322-8720
Email: peter.cummings@vanderbilt.edu

Co-Chair:

Seung Soon Jang
Assistant Professor
Georgia Institute of Technology
School of Materials Science and Engineering
Computational NanoBio Technology Laboratory
Atlanta, GA 30332-0245
Phone Number: 404-385-3356
Email: SeungSoon.Jang@mse.gatech.edu

Papers:

405a

Identifying Drug Binding Locations and Poses Using Hamiltonian Replica Exchange Molecular Dynamics
Kai Wang, University of Virginia; Michael R. Shirts, University of Virginia; John D. Chodera, University of California, Berkeley

405b

Many Integrated Core and the Coming Stampede: Intel Responds to the GPU
Frank T. Willmore, University of Texas at Austin

405c

GPU-Based High Performance Molecular Dynamics Simulation of Highly Heterogeneous Molecular Systems: Application for Three-Phase Model of Polymer Electrolyte Membrane Fuel Cell
Ji Il Choi, Georgia Institute of Technology; Giuseppe F. Brunello, Georgia Institute of Technology; Seung Soon Jang, Georgia Institute of Technology

405d

Optimization of a Lennard-Jones Particle Monte Carlo Gpucode
Jason R. Mick, Wayne State University; Eyad Hailat, Wayne State University; Vincent Russo, Wayne State University; Kamel Ibrahem, Wayne State University; Loren Schwiebert, Wayne State University; Jeffrey J. Potoff, Wayne State University

405e

GPU-Enabled Simulations of Size Effects On the Elongation and Rupture of Metallic Nanowires Using Many-Body Potentials
William R. French, Vanderbilt University; Christopher R. Iacovella, Vanderbilt University; Peter T. Cummings, Oak Ridge National Laboratory

See more of this Group/Topical: Computational Molecular Science and Engineering Forum

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