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Evolutionary design of molecules based on deep learning and a genetic algorithm

Evolutionary design has gained significant attention as a useful tool to accelerate the design process by automatically modifying molecular structures to obtain molecules with the target properties. However, its methodology presents a practical challenge—devising a way in which to rapidly evolve mol...

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Detalles Bibliográficos
Autores principales: Kwon, Youngchun, Kang, Seokho, Choi, Youn-Suk, Kim, Inkoo
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Nature Publishing Group UK 2021
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8397714/
https://www.ncbi.nlm.nih.gov/pubmed/34453086
http://dx.doi.org/10.1038/s41598-021-96812-8