Extending parallel scalability of LAMMPS and multiscale reactive molecular simulations.
Yuxing PengChris KnightPhilip BloodLonnie CrosbyGregory A. VothPublished in: XSEDE (2012)
Keyphrases
- multiscale
- molecular dynamics
- parallel search
- image processing
- image representation
- parallel database systems
- pc cluster
- parallel implementation
- shape representation
- numerical simulations
- scale space
- wavelet transform
- three dimensional
- massively parallel
- parallel computing
- distributed memory
- molecular structure
- wavelet coefficients
- fine scale
- agent architecture
- map reduce
- parallel programming
- shared memory
- neural network
- coarse to fine
- parallel processing
- edge detection
- genetic algorithm