Demystifying Multitask Deep Neural Networks for Quantitative Structure-Activity Relationships.
Yuting XuJunshui MaAndy LiawRobert P. SheridanVladimir SvetnikPublished in: J. Chem. Inf. Model. (2017)
Keyphrases
- quantitative structure activity
- multi task
- neural network
- drug design
- drug discovery
- multitask learning
- multi task learning
- learning tasks
- multiple tasks
- multi class
- data sets
- transfer learning
- feature selection
- gaussian processes
- learning problems
- text categorization
- data mining
- information gain
- high precision
- machine learning