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BRADSHAW: a system for automated molecular design

This paper introduces BRADSHAW (Biological Response Analysis and Design System using an Heterogenous, Automated Workflow), a system for automated molecular design which integrates methods for chemical structure generation, experimental design, active learning and cheminformatics tools. The simple us...

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Detalhes bibliográficos
Publicado no:J Comput Aided Mol Des
Main Authors: Green, Darren V. S., Pickett, Stephen, Luscombe, Chris, Senger, Stefan, Marcus, David, Meslamani, Jamel, Brett, David, Powell, Adam, Masson, Jonathan
Formato: Artigo
Idioma:Inglês
Publicado em: Springer International Publishing 2019
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC7292824/
https://ncbi.nlm.nih.gov/pubmed/31637565
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1007/s10822-019-00234-8
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