DFT-based molecular dynamics as a new tool for computational biology: First applications and perspective.
Wanda AndreoniAlessandro CurioniTiziana MordasiniPublished in: IBM J. Res. Dev. (2001)
Keyphrases
- computational biology
- molecular dynamics
- protein sequences
- sequence analysis
- scientific data
- machine learning
- natural language processing
- molecular dynamics simulations
- high performance computing
- protein folding
- fluid flow
- data analysis
- artificial intelligence
- data management
- numerical simulations
- gene expression profiling