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A Novel Molecular Representation Learning for Molecular Property Prediction with a Multiple SMILES-Based Augmentation

Deep learning has brought a rapid development in the aspect of molecular representation for various tasks, such as molecular property prediction. The prediction of molecular properties is a crucial task in the field of drug discovery for finding specific drugs with good pharmacological activity and...

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Detalles Bibliográficos
Autores principales: Li, Chunyan, Feng, Jihua, Liu, Shihu, Yao, Junfeng
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Hindawi 2022
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8843876/
https://www.ncbi.nlm.nih.gov/pubmed/35178082
http://dx.doi.org/10.1155/2022/8464452