Decoding the Protein-ligand Interactions Using Parallel Graph Neural Networks.
Carter KnutsonMridula BonthaJenna A. BilbreyNeeraj KumarPublished in: CoRR (2021)
Keyphrases
- protein protein
- neural network
- protein interaction
- protein protein interactions
- interaction networks
- computational methods
- protein function
- protein sequences
- drug design
- virtual screening
- predicting protein
- protein function prediction
- high throughput
- protein interaction networks
- protein structure
- drug discovery
- pattern recognition
- directed graph
- protein structure prediction
- systems biology
- graph representation
- genetic algorithm
- graph theory
- cellular processes
- fuzzy logic
- random walk
- parallel computing
- decoding algorithm
- artificial neural networks
- binding sites
- biological processes
- graph structure
- protein complexes
- structured data
- neural network model
- graph matching
- graph mining
- biological data
- shared memory
- biological knowledge
- weighted graph
- depth first search
- sequence alignment
- graph databases