Accelerating molecular dynamics simulations using Graphics Processing Units with CUDA.
Weiguo LiuBertil SchmidtGerrit VossWolfgang Müller-WittigPublished in: Comput. Phys. Commun. (2008)
Keyphrases
- graphics processing units
- molecular dynamics simulations
- compute unified device architecture
- molecular dynamics
- gpu implementation
- high performance computing
- general purpose
- parallel implementation
- graphics processors
- graphics hardware
- parallel computing
- cpu implementation
- parallel computation
- computing systems
- parallel algorithm
- massively parallel
- real time
- parallel processing
- shared memory
- floating point
- efficient implementation
- computing resources
- data analysis