Parametrization of the Elastic Network Model Using High-Throughput Parallel Molecular Dynamics Simulations.
Philipp S. OrekhovIlya V. KirillovVladimir A. FedorovIlya B. KovalenkoNikita B. GudimchukArtem A. ZhmurovPublished in: Supercomput. Front. Innov. (2019)
Keyphrases
- high throughput
- network model
- genome wide
- molecular dynamics simulations
- microarray
- biological data
- molecular dynamics
- systems biology
- neural network
- genomic data
- data acquisition
- protein protein interactions
- gene regulatory networks
- mass spectrometry data
- database systems
- proteomic data
- parallel computing
- massively parallel
- automated image analysis
- data generation
- fine grained
- peer to peer