Molecular Generative Model via Retrosynthetically Prepared Chemical Building Block Assembly (Adv. Sci. 8/2023)

Deep Generative Model A deep generative model for the molecular design based on chemical building block assembly via retrosynthetic reaction rules is reported in article number 2206674 by Seonghwan Seo, Jaechang Lim, and Woo Youn Kim. This work demonstrates the design of novel molecules with target...

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Detalles Bibliográficos
Autores principales: Seo, Seonghwan, Lim, Jaechang, Kim, Woo Youn
Formato: Online Artículo Texto
Lenguaje:English
Publicado: John Wiley and Sons Inc. 2023
Materias:
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Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10015846/
http://dx.doi.org/10.1002/advs.202370047
Descripción
Sumario:Deep Generative Model A deep generative model for the molecular design based on chemical building block assembly via retrosynthetic reaction rules is reported in article number 2206674 by Seonghwan Seo, Jaechang Lim, and Woo Youn Kim. This work demonstrates the design of novel molecules with target properties using building blocks sampled from a chemical catalog. [Image: see text]

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