Scalable Fragment-Based 3D Molecular Design with Reinforcement Learning

1 February 2022

Papers citing "Scalable Fragment-Based 3D Molecular Design with Reinforcement Learning"

2 / 2 papers shown

Title
Equivariant Shape-Conditioned Generation of 3D Molecules for Ligand-Based Drug Design Keir Adams Connor W. Coley 39 25 0 06 Oct 2022
Graph Neural Networks for Molecules Yuyang Wang Zijie Li A. Farimani GNN AI4CE 52 21 0 12 Sep 2022