Integrating Chemical Language and Molecular Graph in Multimodal Fused Deep Learning for Drug Property Prediction.
Xiaohua LuLiangxu XieLei XuRongzhi MaoShan ChangXiaojun XuPublished in: CoRR (2023)
Keyphrases
- deep learning
- drug discovery
- drug design
- chemical compounds
- virtual screening
- unsupervised feature learning
- chemical reactions
- unsupervised learning
- machine learning
- natural language
- deep architectures
- directed graph
- weakly supervised
- mental models
- knn
- pattern recognition
- protein protein interactions
- text classification
- graphical models
- image features
- high dimensional
- learning algorithm