QMflows: A Tool Kit for Interoperable Parallel Workflows in Quantum Chemistry.
Felipe ZapataLars RidderJohan HiddingChristoph R. JacobIvan InfanteLucas VisscherPublished in: J. Chem. Inf. Model. (2019)
Keyphrases
- tool kit
- web services
- parallel implementation
- shared memory
- parallel processing
- data processing
- digital libraries
- business processes
- data sets
- artificial intelligence
- computer architecture
- parallel computation
- knowledge management
- database systems
- case study
- metadata standards
- quantum computing
- parallel hardware
- quantum computation
- neural network