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On modeling and utilizing chemical compound information with deep learning technologies: A task-oriented approach

A large number of chemical compounds are available in databases such as PubChem and ZINC. However, currently known compounds, though large, represent only a fraction of possible compounds, which is known as chemical space. Many of these compounds in the databases are annotated with properties and as...

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Detalles Bibliográficos
Autores principales: Lim, Sangsoo, Lee, Sangseon, Piao, Yinhua, Choi, MinGyu, Bang, Dongmin, Gu, Jeonghyeon, Kim, Sun
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Research Network of Computational and Structural Biotechnology 2022
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9399946/
https://www.ncbi.nlm.nih.gov/pubmed/36051875
http://dx.doi.org/10.1016/j.csbj.2022.07.049