448 search results - page 12 / 90 » Molecular Dynamics Simulation and Visualization |
TRETS
2010
13 years 2 months ago
2010
CCCG
1998
13 years 9 months ago
1998
Molecular surface computations are often necessary in order to perform synthetic drug design. A critical step in this process is the computation and update of an exact boundary re...
VL
2005
IEEE
14 years 1 months ago
2005
IEEE
This paper presents a strategy for the visualization of dynamic object relationships in Java programs. The metaphor of a chemical molecule is used to aid comprehension, and to hel...
ICPP
2006
IEEE
14 years 1 months ago
2006
IEEE
— This paper presents Salsa, a novel, decentralized and asynchronous realization of the “replica exchange” algorithm for simulating the structure, function, folding, and dyna...
VMV
2004
13 years 9 months ago
2004
In this paper we demonstrate how a computational physics approach based on a discrete particle model can be employed for the visualization of magnetic field lines. This can be reg...