Pushing the Boundaries of Molecular Property Prediction for Drug Discovery with Multitask Learning BERT Enhanced by SMILES Enumeration

Xiao-Chen Zhang, Cheng-Kun Wu*, Jia-Cai Yi, Xiang-Xiang Zeng, Can-Qun Yang, Ai-Ping Lu, Ting-Jun Hou*, Dong-Sheng Cao*

*Corresponding author for this work

Research output: Contribution to journalJournal articlepeer-review

32 Citations (Scopus)

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Keyphrases

Computer Science

Chemical Engineering