Predicting molecular properties based on the interpretable graph neural network with multistep focus mechanism.
Yanan TianXiaorui WangXiaojun YaoHuanxiang LiuYing YangPublished in: Briefings Bioinform. (2023)
Keyphrases
- neural network
- artificial neural networks
- graph properties
- graph representation
- graph model
- genetic algorithm
- graph theoretic
- graph structure
- recurrent neural networks
- computational model
- back propagation
- three dimensional
- neural network model
- structured data
- social network analysis
- radial basis function
- bp neural network
- neural nets
- network model
- np complete
- spanning tree
- fuzzy logic
- pairwise