5 search results - page 1 / 1 » Pair interaction energy decomposition analysis |
JCC
2007
13 years 11 months ago
2007
RECOMB
2005
Springer
14 years 11 months ago
2005
Springer
This paper proposes a novel tree decomposition based side-chain assignment algorithm, which can obtain the globally optimal solution of the side-chain packing problem very efficien...
ISCAS
2007
IEEE
14 years 5 months ago
2007
IEEE
— We present a method for fast analysis of signal and power integrity based on a recently developed multilayered finite difference method (M-FDM). In order to accurately model m...
CPHYSICS
2008
13 years 11 months ago
2008
A scalable parallel algorithm has been designed to perform multimillion-atom molecular dynamics (MD) simulations, in which first principlesbased reactive force fields (ReaxFF) des...
NAR
2006
13 years 11 months ago
2006
PHEPS (pH-dependent Protein Electrostatics Server) is a web service for fast prediction and experiment planning support, as well as for correlation and analysis of experimentally ...