679 search results - page 1 / 136 » Molecular structure determination on a computational and dat... |
CCGRID
2004
IEEE
13 years 8 months ago
2004
IEEE
The focus of this paper is on the design and implementation of a critical program in structural biology onto two computational and data grids. The first is the Buffalo-based ACDC ...
CCGRID
2004
IEEE
13 years 8 months ago
2004
IEEE
A new computational framework is developed for the evolutionary determination of molecular crystal structures using the Shake-and-Bake methodology. Genetic algorithms are performe...
IPPS
2009
IEEE
13 years 11 months ago
2009
IEEE
Determining the X-ray crystallographic structures of proteins using the technique of molecular replacement (MR) can be a time and labor-intensive trial-and-error process, involvin...
BMCBI
2010
13 years 4 months ago
2010
Background: RNA structure prediction problem is a computationally complex task, especially with pseudo-knots. The problem is well-studied in existing literature and predominantly ...
SMA
2009
ACM
13 years 11 months ago
2009
ACM
We present the “Dynamic Packing Grid” (DPG) data structure along with details of our implementation and performance results, for maintaining and manipulating flexible molecul...