Uncertainty quantification of molecular property prediction using Bayesian neural network models.
Seongok RyuYongchan KwonWoo Youn KimPublished in: CoRR (2019)
Keyphrases
- neural network model
- bayesian models
- neural network
- artificial neural networks
- multi layer perceptron
- prediction accuracy
- forecasting accuracy
- radial basis function network
- decision theory
- dempster shafer
- multilayer perceptron
- input variables
- prediction model
- maximum likelihood
- bp neural network
- drug design
- growing neural gas
- genetic algorithm
- rbf neural network
- neural models
- network architecture
- bayesian inference
- protein structure prediction
- bayesian networks
- bayesian classifier
- bayesian model