Sciweavers

448 search results - page 21 / 90
» Molecular Dynamics Simulation and Visualization
Sort
View
CPHYSICS
2007
113views more  CPHYSICS 2007»
13 years 7 months ago
Atomic-level simulation of non-equilibrium surface chemical reactions under plasma-wall interaction
Molecular dynamics (MD) simulations are used for the study of non-thermal-equilibrium reactions that take place on the substrate surface during plasma etching processes. In MD sim...
Satoshi Hamaguchi, Masashi Yamashiro, Hideaki Yama...
CIBCB
2006
IEEE
14 years 1 months ago
A Stochastic model to estimate the time taken for Protein-Ligand Docking
Abstract— Quantum mechanics and molecular dynamic simulation provide important insights into structural configurations and molecular interaction data today. To extend this atomi...
Preetam Ghosh, Samik Ghosh, Kalyan Basu, Sajal K. ...
JCC
2006
56views more  JCC 2006»
13 years 7 months ago
A comparative theoretical study of dipeptide solvation in water
: Molecular dynamics studies have been performed on the zwitterionic form of the dipeptide glycine
Håkan W. Hugosson, Alessandro Laio, Patrick ...
IPMI
2007
Springer
14 years 8 months ago
Rao-Blackwellized Marginal Particle Filtering for Multiple Object Tracking in Molecular Bioimaging
Modern live cell fluorescence microscopy imaging systems, used abundantly for studying intra-cellular processes in vivo, generate vast amounts of noisy image data that cannot be pr...
Ihor Smal, Katharina Draegestein, Niels Galjart, W...
IROS
2007
IEEE
104views Robotics» more  IROS 2007»
14 years 2 months ago
Energy-field reconstruction for haptic-based molecular docking using energy minimization processes
— This paper presents a new method allowing haptic feedback in molecular docking simulations using a minimization process. These simulations, classically used by the pharmaceutic...
Bruno Daunay, Alain Micaelli, Stephane Régn...