Molecular dynamics

Results: 1160



#Item
291Molecular dynamics / Computational physics / Computational chemistry / Parallel computing / Gravitation / Multi-core processor / Particle / Cell / Barnes–Hut simulation / Computer architecture / Computing / IBM

Architectural constraints to attain 1 Exaflop/s for three scientific application classes Abhinav Bhatele, Pritish Jetley, Hormozd Gahvari, Lukasz Wesolowski, William D. Gropp, Laxmikant V. Kal´e Department of Computer S

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Source URL: charm.cs.illinois.edu

Language: English - Date: 2011-05-01 22:30:33
292Atomic physics / Molecular physics / Quantum chemistry / Physical chemistry / Ionization / Tunnel ionization / Electron / Chemistry / Physics / Ions

Numerical methods in Strong field dynamics II Correlated Multielectron Dynamics in Intense Light Fields PhD School of the INT-network CORINF – June 2012

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Source URL: www.corinf.eu

Language: English - Date: 2012-11-14 09:54:47
293Mathematics / Linear algebra / Symbol / Wigner quasi-probability distribution / Rotation matrix / Landau–Zener formula / Dual space / Principia Mathematica / Μ operator / Algebra / Quantum mechanics / Physics

Energy level crossings in molecular dynamics F. Bornemann1 , C. Lasser2 , T. Swart2 1 Zentrum Mathematik, Technische Universit¨ at M¨

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Source URL: www-m3.ma.tum.de

Language: English - Date: 2010-05-06 15:47:03
294Science / Physics / Statistical mechanics / Molecular dynamics / Molecular modelling / Dynamical system / Steady state / Non-equilibrium thermodynamics / Simulation / Chemistry / Systems theory / Computational chemistry

Overview of Weighted Ensemble Simulation: Path-sampling, Steady States, Equilibrium Daniel M. Zuckerman, University of Pittsburgh 1 Introduction to Weighted Ensemble Simluation: The very basics

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Source URL: chong.chem.pitt.edu

Language: English - Date: 2013-06-04 13:59:26
295Splines / Mathematical analysis / 3D computer graphics / Mechanics / Cadherin / Non-uniform rational B-spline / Outliner / Maya Embedded Language / 3D modeling / Geometry / Mathematics / Interpolation

Tutorial 1: Cadherin Flexibility Gaël McGill, Ph.D. Center for Molecular and Cellular Dynamics Harvard Medical School & Digizyme, Inc. ------------------------------------------------------------------------------------

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Source URL: www.molecularmovies.com

Language: English - Date: 2008-10-09 16:16:46
296Science / Transport phenomena / Diffusion / Stochastic processes / Brownian motion / Colloidal chemistry / Self-propelled particles / Dynamics / Molecular diffusion / Statistics / Statistical mechanics / Probability and statistics

Berlin Center for Studies of Complex Chemical Systems e. V. Fritz-Haber-Institut der Max-Planck-Gesellschaft, Humboldt-Universit¨ at, Max-Delbru at ¨ck-Centrum fu

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Source URL: www.bcsccs.de

Language: English - Date: 2011-05-20 11:11:51
297Science / Molecular dynamics / Numerical continuation / Chaos theory / Hamiltonian mechanics / Buckling / Dynamical systems / Physics / Mechanics

PDF Document

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Source URL: lcvmwww.epfl.ch

Language: English - Date: 2013-10-25 10:38:54
298Computational chemistry / Molecular dynamics / Protein / Protein folding / Hydrogen bond / Chemistry / Biology / Molecular modelling

How water molecules dance to activate proteins

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Source URL: phys.org

Language: English - Date: 2015-05-31 18:06:06
299FENE / Polymer / Rouse model / Physics / Science / Statistical mechanics / Molecular dynamics / Polymer physics / Polymers / Polymer chemistry

Transient behaviour of a polymer dragged through a viscous medium Hans Vandebroek, Enrico Carlon and Carlo Vanderzande July 17, 2014 We study the properties of a polymer that is being pulled through a fluid, to describe

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Source URL: www.agnld.uni-potsdam.de

Language: English - Date: 2014-09-10 11:38:31
300Mantle / Molecular dynamics / Slab / Perovskite / Seismic tomography / Post-perovskite / Geology / Structure of the Earth / Chemistry

Goldschmidt 2000 September 3rd–8th, 2000 Oxford, UK. Journal of Conference Abstracts Volume 5(2), 751

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Source URL: www.the-conference.com

Language: English - Date: 2009-11-05 07:02:44
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