Load balancing of molecular dynamics simulation with NWChem.
Tjerk P. StraatsmaJames Andrew McCammonPublished in: IBM Syst. J. (2001)
Keyphrases
- load balancing
- molecular dynamics
- molecular dynamics simulations
- high performance computing
- grid computing
- fault tolerance
- scientific data
- dynamic load balancing
- distributed systems
- peer to peer
- load balance
- fault tolerant
- mobile agents
- parallel database systems
- protein folding
- fluid flow
- artificial intelligence
- data generation
- load balancing strategy