Difference between revisions of "Communication"

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=== TGCC/Curie on France 3 ===
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http://www-hpc.cea.fr/fr/complexe/FRANCE_3_reportage_Curie_CEA_130312.swf
  
 
== Pictures ==
 
== Pictures ==

Revision as of 17:40, 24 April 2012

Video files

Full beta-amyloid QMC simulation

Download video files here:

or view on-line:

Amyloid Beta peptide, 28 residues
A stochastic trajectory for the 1731 electrons of systems.
Click on the image to see the animation.

TGCC/Curie on France 3

http://www-hpc.cea.fr/fr/complexe/FRANCE_3_reportage_Curie_CEA_130312.swf

Pictures

QMC

Qmc.png

Overview of a Quantum Monte Carlo simulation. Apart from the initialization and finalization step, all the processes are completely independent.

Beta-amyloid

Peptide.png

Stochastic trajectories of electrons around the nuclei on the beta-amyloid simulated on Curie in Dec 2011. Different electron colors represent different time steps.

Peptide nozoom.png

Stochastic trajectories of electrons around the nuclei on the beta-amyloid simulated on Curie in Dec 2011. Electrons are repesented in gold, and a few time steps in the past are represented as the footprints of the electrons.

Alpha-beta.png

The two beta-amyloid structures simulated on Curie in Dec 2011 (122 atoms, 434 electrons). The energy difference between these two structures was computed with QMC=Chem.