Generating 3D Molecular Structures Conditional on a Receptor Binding Site with Deep Generative Models.
Tomohide MasudaMatthew RagozaDavid Ryan KoesPublished in: CoRR (2020)
Keyphrases
- generative model
- molecular structures
- binding sites
- augmented reality
- probabilistic model
- three dimensional
- discriminative learning
- hierarchical hidden markov models
- prior knowledge
- sequence data
- gene expression
- conditional random fields
- transcription factors
- semi supervised
- dna sequences
- em algorithm
- discriminative models
- statistical significance
- deep belief networks
- conditional probabilities
- expectation maximization
- virtual reality