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JCC
2008
138views more  JCC 2008»
14 years 9 months ago
Circular dichroism enhancement in large DNA aggregates simulated by a generalized oscillator model
Abstract: An increased circular dichroism (CD) signal of large molecular aggregates formed upon DNA condensation was observed a long time ago, and is often referred to as w-CD. The...
Valery Andrushchenko, Petr Bour
JCIT
2008
173views more  JCIT 2008»
14 years 9 months ago
A Multilevel Semantic Document Classifier Based On SVM Integrated With Domain Ontologies
A multilevel semantic document classification system based on Support Vector Machine (SVM) in association with domain ontologies has been developed. The documents related to the s...
Vijayasundaram Uma, Punnaivanam Sankar, Gnanasekar...
JCB
2006
79views more  JCB 2006»
14 years 9 months ago
A Stability Boundary Based Method for Finding Saddle Points on Potential Energy Surfaces
The task of finding saddle points on potential energy surfaces plays a crucial role in understanding the dynamics of a micromolecule as well as in studying the folding pathways of...
Chandan K. Reddy, Hsiao-Dong Chiang
JCC
2006
103views more  JCC 2006»
14 years 9 months ago
Flooding in GROMACS: Accelerated barrier crossings in molecular dynamics
: The major bottleneck of today's atomistic molecular dynamics (MD) simulations is that because of the enormous computational effort involved, only processes at nanoseconds to...
Oliver F. Lange, Lars V. Schäfer, Helmut Grub...
GRID
2007
Springer
14 years 9 months ago
The Requirements of Using Provenance in e-Science Experiments
In e-Science experiments, it is vital to record the experimental process for later use such as in interpreting results, verifying that the correct process took place or tracing whe...
Simon Miles, Paul T. Groth, Miguel Branco, Luc Mor...