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AK-Score: Accurate Protein-Ligand Binding Affinity Prediction Using an Ensemble of 3D-Convolutional Neural Networks

Accurate prediction of the binding affinity of a protein-ligand complex is essential for efficient and successful rational drug design. Therefore, many binding affinity prediction methods have been developed. In recent years, since deep learning technology has become powerful, it is also implemented...

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Detalles Bibliográficos
Autores principales: Kwon, Yongbeom, Shin, Woong-Hee, Ko, Junsu, Lee, Juyong
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2020
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7697539/
https://www.ncbi.nlm.nih.gov/pubmed/33182567
http://dx.doi.org/10.3390/ijms21228424