Implementation of Hybrid Monte Carlo (Molecular Dynamics) Quantum Mechanical Methodology for Modeling of Condensed Phases on High Performance Computing Environment.
Anastas MisevDragan SahpaskiLjupco PejovPublished in: ICT Innovations (2011)
Keyphrases
- monte carlo
- computing environments
- molecular dynamics
- high performance computing
- markov chain
- distributed computing environment
- monte carlo simulation
- importance sampling
- monte carlo tree search
- grid computing
- adaptive sampling
- service discovery
- pervasive computing environments
- markovian decision
- scientific data
- mobile agents
- intelligent agents
- molecular dynamics simulations
- active learning