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2205.10473
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De novo design of protein target specific scaffold-based Inhibitors via Reinforcement Learning
21 May 2022
Andrew D. McNaughton
Mridula Bontha
C. Knutson
Jenna A. Pope
Neeraj Kumar
AI4CE
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Papers citing
"De novo design of protein target specific scaffold-based Inhibitors via Reinforcement Learning"
2 / 2 papers shown
Title
Graph Convolutional Policy Network for Goal-Directed Molecular Graph Generation
Jiaxuan You
Bowen Liu
Rex Ying
Vijay S. Pande
J. Leskovec
GNN
181
878
0
07 Jun 2018
Junction Tree Variational Autoencoder for Molecular Graph Generation
Wengong Jin
Regina Barzilay
Tommi Jaakkola
208
1,205
0
12 Feb 2018
1