June 17-21, 2012

Hamburg, Germany

Event Details

Name: Computational Chemistry
Time: Wednesday, June 20, 2012
9:00 AM - 10:30 AM
Room:   Hall B
CCH - Congress Center Hamburg
Chair(s):   Jürgen Enders, AI&S Beratende Ingenieure
Abstract:   Computational Chemistry is a fairly new discipline in natural science.

This session will elucidate today’s state of the art possibilities in C – chemistry and also give an outlook to future solution platforms, i.e. current and future Supercomputer platforms, cloud computing and software to solve problems in these scenarios.

A well known example is the evaluation and description of the Human Genome. Imagine this task had to be done with the Pascaline or Schickards mechanical calculation machine...

In the next years events we like to broaden the focus of this session into more topics related to systemic biology, protein chemistry and of course medical computer aided solutions.
Contributions: Ab Initio Simulations on Blue Gene Platforms: Prebiotic Chemistry in the
  9:00 AM - 9:30 AM  
    Dominik Marx, Ruhr-Universität Bochum
Modeling DNA Radiation Damage on Many-Core Architectures: The New GPU Version of SCELib for Microsoft HPC & Azure
  9:30 AM - 10:00 AM  
    Nico Sanna, CASPUR
  10:00 AM - 10:30 AM  
    Frank Schaffer, Accelrys
  • Tutorial Pass
  • HPC in Asia Workshop Pass
  • Conference Pass
  • Conference Pass or Exhibition Pass
    Satellite Event marked with * requires separate pass
  • Morning & Afternoon Coffee Breaks
    Midday Lunch Break
Program may be subject to changes.