A 3D Generative Model for Structure-Based Drug Design.

Shitong Luo Jiaqi Guan Jianzhu Ma Jian Peng

Published in: NeurIPS (2021)

Keyphrases

generative model
drug design
probabilistic model
prior knowledge
em algorithm
pitman yor process
semi supervised
information retrieval
machine learning
image processing
pairwise
protein protein interactions