Advances and Challenges in De Novo Drug Design Using Three-Dimensional Deep Generative Models.
Weixin XieFanhao WangYibo LiLuhua LaiJianfeng PeiPublished in: J. Chem. Inf. Model. (2022)
Keyphrases
- generative model
- drug design
- three dimensional
- probabilistic model
- discriminative learning
- conditional random fields
- em algorithm
- hierarchical hidden markov models
- generative and discriminative models
- protein structure prediction
- prior knowledge
- protein protein interactions
- drug discovery
- semi supervised
- discriminative models
- deep belief networks
- expectation maximization
- pairwise
- data analysis
- bayesian networks