A copy of this work was available on the public web and has been preserved in the Wayback Machine. The capture dates from 2017; you can also visit the original URL.
The file type is application/pdf
.
Interactive Molecular Dynamics: Scaling up to Large Systems
2013
Procedia Computer Science
Combining molecular dynamics simulations with user interaction would have various applications in both education and research. By enabling interactivity the scientist will be able to visualize the experiment in real time and drive the simulation to a desired state more easily. However, interacting with systems of interesting size requires significant computing resources due to the complexity of the simulation. In this paper, we propose an approach to combine a classical parallel molecular
doi:10.1016/j.procs.2013.05.165
fatcat:fedek7baivfprmuvgqnskxuwe4