Component-based integration of chemistry and optimization software.
Joseph P. KennySteven BensonYuri AlexeevJason SarichCurtis L. JanssenLois Curfman McInnesManojkumar KrishnanJarek NieplochaElizabeth JurrusCarl FahlstromTheresa L. WindusPublished in: J. Comput. Chem. (2004)
Keyphrases
- organic chemistry
- optimization problems
- source code
- global optimization
- computer systems
- case study
- data sources
- optimization strategies
- metadata
- software design
- information systems
- optimization methods
- information integration
- software platform
- configuration management
- software architecture
- discrete optimization
- constrained optimization
- software tools
- embedded systems
- data mining
- optimization algorithm
- software development
- data model
- web services
- genetic algorithm