592 search results - page 76 / 119 » Large Scale Simulation of Parallel Molecular Dynamics |
PDPTA
2000
13 years 10 months ago
2000
Exploiting compile time knowledge to improve memory bandwidth can produce noticeable improvements at run-time [13, 1]. Allocating the data structure [13] to separate memories when...
ICPP
1995
IEEE
14 years 21 days ago
1995
IEEE
Interactive program steering permits researchers to monitor and guide their applications during runtime. Interactive steering can help make end users more effective in addressing ...
SCFBM
2008
13 years 8 months ago
2008
Background: CRANKITE is a suite of programs for simulating backbone conformations of polypeptides and proteins. The core of the suite is an efficient Metropolis Monte Carlo sample...
IPPS
2010
IEEE
13 years 7 months ago
2010
IEEE
Quantum chemistry applications such as the General Atomic and Molecular Electronic Structure System (GAMESS) that can execute on a complex peta-scale parallel computing environment...
GECCO
2004
Springer
14 years 2 months ago
2004
Springer
This paper first analyzes the feedback principle of nature immune system and then the immune process is imitated by virtue of nonlinear molecular dynamics. Then the mathematic mode...