Large Scale Biomolecular Dynamics Simulations - prace

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RNA Secondary Structure Prediction Bringloe et al. J. Gener. Virol. 79 (1998) p. 1539 onsdag, 2009 maj 13
The goal is not merely reproducing experimental results. onsdag, 2009 maj 13
Page 1 and 2: XXL-BIOMD Large Scale Biomolecular
Page 3 and 4: Protein BBA5: 4000 Waters: Total: 4
Page 5 and 6: BBA5 folding: CPU Time • 12400 at
Page 7 and 8: Simulation vs. Experiments Experime
Page 9 and 10: DPPC & Cholesterol: 130k atoms Blue
Page 11 and 12: The Eighth-Sphere Method • Smarte
Page 13 and 14: Scaling - DHFR 23558 atoms
Page 15 and 16: Deisa Extreme Computing Initiative
Page 17 and 18: Why study viruses? • New viral di
Page 19 and 20: 5 ns simulation. Blue: protein. Gre
Page 21: onsdag, 2009 maj 13
Page 25 and 26: Simulation Details • 1,000,000+ p
Page 27 and 28: Superposition of 60 monomers after
Page 29 and 30: onsdag, 2009 maj 13 Size of the vir
Page 31 and 32: onsdag, 2009 maj 13 Physiological C
Page 33 and 34: Questions & future plans... • Wha
Page 35: Molecular Biophysics, Uppsala Danie

Large Scale Biomolecular Dynamics Simulations - prace

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