Molecule Design Using Molecular Generative Models Constrained by Ligand-Protein Interactions.

Jie Zhang Hongming Chen

Published in: J. Chem. Inf. Model. (2022)

Keyphrases

generative model
probabilistic model
drug discovery
prior knowledge
protein protein interactions
protein interaction
conditional random fields
high precision
discriminative learning
co occurrence
text classification
bayesian inference
generative and discriminative models