Framework-based design of a new all-purpose molecular simulation application: The Adun simulator.
Michael A. JohnstonIgnacio Fdez. GalvánJordi Villà-FreixaPublished in: J. Comput. Chem. (2005)
Keyphrases
- simulation environment
- molecular dynamics
- simulation tool
- conceptual framework
- design principles
- simulation model
- simulation platform
- main contribution
- computational framework
- modular design
- case study
- model driven engineering
- design space exploration
- design rationale
- design decisions
- software architecture
- design process
- building blocks
- design patterns
- core components
- theoretical framework
- simulation tools
- knowledge based systems
- software engineering
- three dimensional
- neural network
- software suite