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Deep Generative Models for 3D Linker Design

[Image: see text] Rational compound design remains a challenging problem for both computational methods and medicinal chemists. Computational generative methods have begun to show promising results for the design problem. However, they have not yet used the power of three-dimensional (3D) structural...

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Detalles Bibliográficos
Autores principales: Imrie, Fergus, Bradley, Anthony R., van der Schaar, Mihaela, Deane, Charlotte M.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2020
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7189367/
https://www.ncbi.nlm.nih.gov/pubmed/32195587
http://dx.doi.org/10.1021/acs.jcim.9b01120