3 search results - page 1 / 1 » Utilizing Averaged Configuations from Molecular Dynamics Sim... |
HPCS
2007
IEEE
13 years 11 months ago
2007
IEEE
One of the challenges in the large-scale simulations required for many molecular systems (such as those of biological interested) is the recording, monitoring and visualization of...
MMAS
2011
Springer
12 years 12 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...
SCFBM
2008
13 years 4 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...