739 search results - page 8 / 148 » Parallel Implementation of a Molecular Dynamics Simulation P... |
BIOINFORMATICS
2007
13 years 7 months ago
2007
IPPS
2007
IEEE
14 years 1 months ago
2007
IEEE
1 Multi-paradigm, multi-threaded and multi-core computing devices available today provide several orders of magnitude performance improvement over mainstream microprocessors. These...
IPPS
2008
IEEE
14 years 1 months ago
2008
IEEE
Processing nodes of the Cray XT and IBM Blue Gene Massively Parallel Processing (MPP) systems are composed of multiple execution units, sharing memory and network subsystems. Thes...
CPHYSICS
2008
13 years 7 months ago
2008
A scalable parallel algorithm has been designed to study long-time dynamics of many-atom systems based on the nudged elastic band method, which performs mutually constrained molec...
JCC
2006
13 years 7 months ago
2006
: The major bottleneck of today's atomistic molecular dynamics (MD) simulations is that because of the enormous computational effort involved, only processes at nanoseconds to...