Sciweavers

679 search results - page 10 / 136
» Molecular structure determination on a computational and dat...
Sort
View
GRID
2003
Springer
14 years 25 days ago
On-Demand Grid Application Tuning and Debugging with the NetLogger Activation Service
Typical Grid computing scenarios involve many distributed hardware and software components. The more components that are involved, the more likely it is that one of them may fail....
Dan Gunter, Brian Tierney, Craig E. Tull, Vibha Vi...
WABI
2009
Springer
102views Bioinformatics» more  WABI 2009»
14 years 2 months ago
A Tree Based Method for the Rapid Screening of Chemical Fingerprints
Background: The fingerprint of a molecule is a bitstring based on its structure, constructed such that structurally similar molecules will have similar fingerprints. Molecular fin...
Thomas G. Kristensen, Jesper Nielsen, Christian N....
ISPA
2007
Springer
14 years 1 months ago
Grid and Distributed Public Computing Schemes for Structural Proteomics: A Short Overview
Grid and distributed public computing schemes has become an essential tool for many scientific fields including bioinformatics, computational biology and systems biology. The adopt...
Azhar Ali Shah, Daniel Barthel, Natalio Krasnogor
RECOMB
2004
Springer
14 years 8 months ago
Discovering temporal relations in molecular pathways using protein-protein interactions
The availability of large-scale protein-protein interaction data provides us with many opportunities to study molecular pathways involving proteins. In this paper we propose to mi...
Martin Farach-Colton, Yang Huang, John L. L. Woolf...
SMA
2009
ACM
137views Solid Modeling» more  SMA 2009»
14 years 2 months ago
Hierarchical molecular interfaces and solvation electrostatics
Electrostatic interactions play a significant role in determining the binding affinity of molecules and drugs. While significant effort has been devoted to the accurate computat...
Chandrajit L. Bajaj, Shun-Chuan Albert Chen, Guoli...