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Generative Recurrent Networks for De Novo Drug Design

Generative artificial intelligence models present a fresh approach to chemogenomics and de novo drug design, as they provide researchers with the ability to narrow down their search of the chemical space and focus on regions of interest. We present a method for molecular de novo design that utilizes...

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Dades bibliogràfiques
Publicat a:Mol Inform
Autors principals: Gupta, Anvita, Müller, Alex T., Huisman, Berend J. H., Fuchs, Jens A., Schneider, Petra, Schneider, Gisbert
Format: Artigo
Idioma:Inglês
Publicat: John Wiley and Sons Inc. 2017
Matèries:
Accés en línia:https://ncbi.nlm.nih.gov/pmc/articles/PMC5836943/
https://ncbi.nlm.nih.gov/pubmed/29095571
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1002/minf.201700111
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