Using Graph Partitioning for Scalable Distributed Quantum Molecular Dynamics.
Hristo N. DjidjevGeorg HahnSusan M. MniszewskiChristian F. A. NegreAnders M. N. NiklassonPublished in: Algorithms (2019)
Keyphrases
- graph partitioning
- scalable distributed
- molecular dynamics
- partitioning algorithm
- graph model
- image segmentation
- high performance computing
- scientific data
- molecular dynamics simulations
- clustering algorithm
- weighted graph
- data clustering
- file system
- spectral clustering
- protein folding
- normalized cut
- fluid flow
- data generation
- superpixels
- dynamical systems
- model selection