Improvement of Prediction Performance With Conjoint Molecular Fingerprint in Deep Learning

The accurate predicting of physical properties and bioactivity of drug molecules in deep learning depends on how molecules are represented. Many types of molecular descriptors have been developed for quantitative structure-activity/property relationships quantitative structure-activity relationships...

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Detalles Bibliográficos
Autores principales: Xie, Liangxu, Xu, Lei, Kong, Ren, Chang, Shan, Xu, Xiaojun
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Frontiers Media S.A. 2020
Materias:
Pharmacology
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7819282/
https://www.ncbi.nlm.nih.gov/pubmed/33488387
http://dx.doi.org/10.3389/fphar.2020.606668

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7819282/
https://www.ncbi.nlm.nih.gov/pubmed/33488387
http://dx.doi.org/10.3389/fphar.2020.606668

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