Proteome-scale Deployment of Protein Structure Prediction Workflows on the Summit Supercomputer.
Mu GaoMark ColettiRussell B. DavidsonRyan ProutSubil AbrahamBenjamín HernándezAda SedovaPublished in: IPDPS Workshops (2022)
Keyphrases
- protein structure prediction
- protein sequences
- protein structure
- computational biology
- data processing
- protein homology
- protein fold recognition
- coarse grained
- drug design
- graph theory
- amino acids
- building blocks
- secondary structure
- protein folding
- web services
- business processes
- computational methods
- massively parallel
- knowledge society
- data mining