139 search results - page 12 / 28 » The molecular modeling toolkit: A new approach to molecular ... |
BIOINFORMATICS
2012
11 years 10 months ago
2012
Summary: The MolClass toolkit and data portal generates computational models from user-defined small molecule datasets based on structural features identified in hit and non-hit m...
CCE
2010
13 years 5 months ago
2010
AbstrAct A comprehensive overview of numerical methodologies currently available for analyzing and building understanding of complex processes is presented. Both equation-free and ...
ICCS
2007
Springer
13 years 11 months ago
2007
Springer
A new approach is proposed to generate workflow scenarios of scientific applications such as Molecular Dynamics and Monte-Carlo simulations in a distributed environment. The approa...
ATAL
2003
Springer
14 years 24 days ago
2003
Springer
We apply the multi-agent system (MAS) platform to the task of biological network simulation. In this paper, we describe the simulation of signal transduction (ST) networks using t...
ENGL
2007
13 years 7 months ago
2007
— This paper presents an interactive method of modelling the various kind of fluid based on Smoothed Particle Hydrodynamics (SPH) in modelling and simulating the gas flow with fr...