Discovery of a Novel and Potent LCK Inhibitor for Leukemia Treatment via Deep Learning and Molecular Docking.
Hao GuoZheyuan ShenYong-yi YuanRou-fen ChenJing-yi YangXing-chen LiuQing ZhangQian-ying PanJian-jun DingXin-jun HeQing-nan ZhangXiaowu DongKe-shu ZhouPublished in: J. Chem. Inf. Model. (2024)
Keyphrases
- deep learning
- hiv protease
- coarse grained
- drug resistance
- acute myeloid
- human immunodeficiency virus
- fine grained
- unsupervised learning
- machine learning
- protein protein interactions
- unsupervised feature learning
- sequence analysis
- mental models
- knowledge discovery
- weakly supervised
- linear support vector machines
- deep architectures
- data mining
- decision trees
- learning algorithm