Improving Molecule Generation and Drug Discovery with a Knowledge-enhanced Generative Model.

Aditya Malusare Vaneet Aggarwal

Published in: CoRR (2024)

Keyphrases

generative model
drug discovery
prior knowledge
probabilistic model
data mining tools
pharmaceutical industry
knowledge discovery
early stage
topic models
scientific data
em algorithm
bayesian framework
data sets
complex systems
biological systems
maximum likelihood
clustering algorithm
virtual screening
databases