Molecular dynamics

Results: 1160



#Item
221

High Performance Computing II Lecture 8 Topic 2: Molecular Dynamics of Lennard-Jones System (continued) In the systolic algorithm, the N particles are decomposed into subsets which are

Add to Reading List

Source URL: www.physics.buffalo.edu

Language: English - Date: 2014-03-25 12:14:09
    222

    Vorträge im Fakultätskolloquium WSFakultät für Chemie der Universität Wien Dr. Gerhard Hummer / Max-Planck Institut für Biophysik „Molecular simulation of protein dynamics and function” Termin:

    Add to Reading List

    Source URL: chemie.univie.ac.at

    Language: German - Date: 2014-10-31 12:11:53
      223

      Using molecular dynamics to quantify the electrical double layer and examine the potential for its direct observation in the in-situ TEM

      Add to Reading List

      Source URL: www.ascimaging.com

      Language: English
        224Parallel computing / Applied mathematics / Scientific modeling / Molecular dynamics / Molecular modelling / Theoretical computer science / Automatic parallelization / Speedup / Simulation / Computational chemistry / Computing / Science

        Scalable Time-Parallelization of Molecular Dynamics Simulations in Nano Mechanics Yanan Yu Ashok Srinivasan

        Add to Reading List

        Source URL: www.cs.fsu.edu

        Language: English - Date: 2006-05-09 11:13:56
        225Kan Lal Agarwal / Biochemistry / Proteins / Molecular biologists / Biology

        Molecular simulation of protein dynamics and function Gerhard Hummer Department of Theoretical Biophysics, Max Planck Institute of Biophysics, Frankfurt, Germany (Email: ) The combination of

        Add to Reading List

        Source URL: chemie.univie.ac.at

        Language: English - Date: 2014-08-27 06:23:19
        226Computational science / Science / Particle / Plasma / Magnetic reconnection / Molecular dynamics / Physics / Computational fluid dynamics / Plasma physics

        2008 US-Japan Workshop on Progress of Multi-Scale Simulation Models Development of multi-scale simulation method via pseudo-particle method Shuhei Numazawa1, Zensho Yoshida1 Graduate School of Frontier Sciences, The Uni

        Add to Reading List

        Source URL: hagar.ph.utexas.edu

        Language: English - Date: 2008-09-29 17:35:48
        227Biology / Protein folding / Energy landscape / Molecular dynamics / Folding funnel / Protein structure prediction / Lattice protein / Protein domain / Implicit solvation / Protein structure / Chemistry / Science

        Emergent organisation in complex biomolecular systems EMBIO Activity code addressed: NEST-2003-Path-1 Abstract Complexity and self-organisation are critical yet poorly understood phenomena. This project aims to develop a

        Add to Reading List

        Source URL: www-embio.ch.cam.ac.uk

        Language: English - Date: 2004-12-03 06:03:06
        228Molecular modelling / Molecular dynamics / NAMD / Simulation / Hydrogen bond / Visual Molecular Dynamics / Chemistry / Science / Computational chemistry

        University of Illinois at Urbana-Champaign Beckman Institute for Advanced Science and Technology Theoretical and Computational Biophysics Group Computational Biophysics Workshop Stretching Deca-alanine

        Add to Reading List

        Source URL: www.ks.uiuc.edu

        Language: English
        229Charge carriers / Physical chemistry / Molecular dynamics / Laser / Electron / Chemical bond / Chemical reaction / Ion / Free-electron laser / Physics / Chemistry / Science

        European Cooperation in the field of Scientific and Technical Research - COST - Brussels, 21 November 2012

        Add to Reading List

        Source URL: w3.cost.eu

        Language: English - Date: 2012-12-06 05:23:09
        230Application programming interfaces / Computer programming / Algorithm / Virial theorem / Molecular dynamics / Message Passing Interface / Parallel computing / Computing / Physics

        High Performance Computing II Lecture 7 Topic 2: Molecular Dynamics of Lennard-Jones System (continued) The most time consuming part of an MD calculation is the evaluation of the accelerations of the particles at each t

        Add to Reading List

        Source URL: www.physics.buffalo.edu

        Language: English - Date: 2014-03-25 12:14:09
        UPDATE