Are we Making Much Progress? Revisiting Chemical Reaction Yield Prediction from an Imbalanced Regression Perspective.
Yihong MaXiaobao HuangBozhao NanNuno MonizXiangliang ZhangOlaf WiestNitesh V. ChawlaPublished in: WWW (Companion Volume) (2024)
Keyphrases
- chemical reaction
- prediction accuracy
- prediction algorithm
- prediction model
- regression model
- machine learning
- linear regression model
- viewpoint
- model selection
- multiple linear regression
- linear regression
- regression algorithm
- survival analysis
- data sets
- regression analysis
- radial basis function network
- target variable
- chemical reactions
- regression problems
- class imbalance
- class distribution
- support vector regression
- multi class
- active learning
- decision trees