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A flexible data-free framework for structure-based de novo drug design with reinforcement learning.

Authors :
Du, Hongyan
Jiang, Dejun
Zhang, Odin
Wu, Zhenxing
Gao, Junbo
Zhang, Xujun
Wang, Xiaorui
Deng, Yafeng
Kang, Yu
Li, Dan
Pan, Peichen
Hsieh, Chang-Yu
Hou, Tingjun
Source :
Chemical Science; 11/21/2023, Vol. 14 Issue 43, p12166-12181, 16p
Publication Year :
2023

Details

Language :
English
ISSN :
20416520
Volume :
14
Issue :
43
Database :
Complementary Index
Journal :
Chemical Science
Publication Type :
Academic Journal
Accession number :
173494690
Full Text :
https://doi.org/10.1039/d3sc04091g