InteractionNet: Modeling and Explaining of Noncovalent Protein-Ligand Interactions with Noncovalent Graph Neural Network and Layer-Wise Relevance Propagation.
Hyeoncheol ChoEok Kyun LeeInsung S. ChoiPublished in: CoRR (2020)
Keyphrases
- neural network
- protein protein
- protein interaction
- multi layer
- drug design
- graph representation
- random walk
- information retrieval
- artificial neural networks
- back propagation
- protein function
- neural network model
- protein sequences
- protein structure
- interaction networks
- drug discovery
- protein protein interactions
- graph structure
- neural nets
- computational methods
- directed acyclic graph
- bipartite graph
- activation function
- recurrent neural networks
- gene expression
- protein structure prediction
- protein interaction networks
- self organizing maps
- single layer
- knn
- pairwise
- search engine
- protein function prediction