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MultiGran-SMILES: multi-granularity SMILES learning for molecular property prediction

Jiang, J; Zhang, RS; Zhao, ZL; Ma, J; Liu, YW; Yuan, YN; Niu, BJ

Zhang, RS (通讯作者),Lanzhou Univ, Sch Informat Sci & Engn, Lanzhou 730000, Peoples R China.

BIOINFORMATICS, 2022; 38 (19): 4573

Abstract

Motivation: Extracting useful molecular features is essential for molecular property prediction. Atom-level representation is a common representation ......

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