Exploring Fragment Adding Strategies to Enhance Molecule Pretraining in AI-Driven Drug Discovery
Author:
Affiliation:
1. School of Life Sciences, Shandong University,Qingdao,China,266237
2. School of Computer Science and Technology, Shandong University,Qingdao,China,266237
3. Shandong University,State Key Laboratory of Microbiology Technology,Qingdao,China,266237
Funder
National Key R&D Program of China
National Natural Science Foundation of China
Publisher
Tsinghua University Press
Link
http://xplorestaging.ieee.org/ielx7/8254253/10654612/10452166.pdf?arnumber=10452166
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5. Small molecules and their impact in drug discovery: A perspective on the occasion of the 125th anniversary of the Bayer Chemical Research Laboratory
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