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G-Networks to Predict the Outcome of Sensing of Toxicity

G-Networks and their simplified version known as the Random Neural Network have often been used to classify data. In this paper, we present a use of the Random Neural Network to the early detection of potential of toxicity chemical compounds through the prediction of their bioactivity from the compo...

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Detalles Bibliográficos
Autores principales: Grenet, Ingrid, Yin, Yonghua, Comet, Jean-Paul
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2018
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6210391/
https://www.ncbi.nlm.nih.gov/pubmed/30332807
http://dx.doi.org/10.3390/s18103483
Descripción
Sumario:G-Networks and their simplified version known as the Random Neural Network have often been used to classify data. In this paper, we present a use of the Random Neural Network to the early detection of potential of toxicity chemical compounds through the prediction of their bioactivity from the compounds’ physico-chemical structure, and propose that it be automated using machine learning (ML) techniques. Specifically the Random Neural Network is shown to be an effective analytical tool to this effect, and the approach is illustrated and compared with several ML techniques.