High-performance computing in chemistry: NW Chem.
Martyn F. GuestEdoardo ApràDavid E. BernholdtHerbert A. FrüchtlRobert J. HarrisonRicky A. KendallR. A. KuttehX. LongJohn B. NicholasJeffrey A. NicholsH. L. TaylorAdrian T. WongGeorge I. FannRichard J. LittlefieldJarek NieplochaPublished in: Future Gener. Comput. Syst. (1996)
Keyphrases
- high performance computing
- scientific computing
- massively parallel
- parallel computing
- computational science
- computing resources
- fault tolerance
- energy efficiency
- computing systems
- high performance data mining
- grid computing
- national laboratory
- molecular dynamics
- computing environments
- heterogeneous computing
- fault tolerant
- power consumption
- load balancing
- cloud computing
- computer systems
- intelligent systems
- graphical models
- sensor networks
- multi agent systems