A 3D Molecule Generative Model for Structure-Based Drug Design.
Shitong LuoJiaqi GuanJianzhu MaJian PengPublished in: CoRR (2022)
Keyphrases
- generative model
- drug design
- probabilistic model
- em algorithm
- prior knowledge
- latent dirichlet allocation
- semi supervised
- drug discovery
- topic models
- structural properties
- generative and discriminative models
- data analysis
- pitman yor process
- computational biology
- fine grained
- expectation maximization
- co occurrence
- supervised learning