Jointly Modelling Uncertainty and Diversity for Active Molecular Property Prediction.
Kuangqi ZhouKaixin WangJian TangJiashi FengBryan HooiPeilin ZhaoTingyang XuXinchao WangPublished in: LoG (2022)
Keyphrases
- prediction accuracy
- prediction algorithm
- uncertain data
- drug design
- prediction model
- neural network
- protein function prediction
- three dimensional
- possibility theory
- prediction intervals
- drug discovery
- belief functions
- conditional probabilities
- augmented reality
- motion estimation
- case study
- decision trees
- artificial intelligence