Three-Dimensional Convolutional Neural Networks and a Cross-Docked Data Set for Structure-Based Drug Design.

Francoeur, Paul G; Masuda, Tomohide; Sunseri, Jocelyn; Jia, Andrew; Iovanisci, Richard B; Snyder, Ian; Koes, David R

Francoeur, Paul G; Masuda, Tomohide; Sunseri, Jocelyn; Jia, Andrew; Iovanisci, Richard B; Snyder, Ian; Koes, David R.

Afiliação

Francoeur PG; Department of Computational and Systems Biology, University of Pittsburgh, Pittsburgh, Pennsylvania 15260, United States.
Masuda T; Department of Computational and Systems Biology, University of Pittsburgh, Pittsburgh, Pennsylvania 15260, United States.
Sunseri J; Department of Computational and Systems Biology, University of Pittsburgh, Pittsburgh, Pennsylvania 15260, United States.
Jia A; Department of Computational and Systems Biology, University of Pittsburgh, Pittsburgh, Pennsylvania 15260, United States.
Iovanisci RB; Department of Computational and Systems Biology, University of Pittsburgh, Pittsburgh, Pennsylvania 15260, United States.
Snyder I; Department of Computational and Systems Biology, University of Pittsburgh, Pittsburgh, Pennsylvania 15260, United States.
Koes DR; Department of Computational and Systems Biology, University of Pittsburgh, Pittsburgh, Pennsylvania 15260, United States.

J Chem Inf Model ; 60(9): 4200-4215, 2020 09 28.

Article em En | MEDLINE | ID: mdl-32865404

Assuntos

Desenho de Fármacos; Redes Neurais de Computação; Bases de Dados de Proteínas; Ligantes; Ligação Proteica

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Texto completo: 1 Base de dados: MEDLINE Assunto principal: Desenho de Fármacos / Redes Neurais de Computação Idioma: En Ano de publicação: 2020 Tipo de documento: Article País de afiliação: Estados Unidos

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