255 search results - page 4 / 51 » Scalable Molecular Dynamics for Large Biomolecular Systems |
ISCA
2007
IEEE
14 years 1 months ago
2007
IEEE
The ability to perform long, accurate molecular dynamics (MD) simulations involving proteins and other biological macromolecules could in principle provide answers to some of the ...
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...
MMAS
2011
Springer
13 years 2 months ago
2011
Springer
While existing mathematical descriptions can accurately account for phenomena at microscopic scales (e.g. molecular dynamics), these are often high-dimensional, stochastic and thei...
BMCBI
2005
13 years 7 months ago
2005
Background: Normal mode analysis (NMA) has become the method of choice to investigate the slowest motions in macromolecular systems. NMA is especially useful for large biomolecula...
BICOB
2009
Springer
14 years 1 months ago
2009
Springer
Atomistic molecular dynamics (MD) simulations are a vital tool in chemical research, as they are able to provide a view of chemical systems and processes that is not obtainable thr...