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A Cascade Graph Convolutional Network for Predicting Protein–Ligand Binding Affinity

Accurate prediction of binding affinity between protein and ligand is a very important step in the field of drug discovery. Although there are many methods based on different assumptions and rules do exist, prediction performance of protein–ligand binding affinity is not satisfactory so far. This pa...

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Bibliografische gegevens
Gepubliceerd in:Int J Mol Sci
Hoofdauteurs: Shen, Huimin, Zhang, Youzhi, Zheng, Chunhou, Wang, Bing, Chen, Peng
Formaat: Artigo
Taal:Inglês
Gepubliceerd in: MDPI 2021
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Online toegang:https://ncbi.nlm.nih.gov/pmc/articles/PMC8070477/
https://ncbi.nlm.nih.gov/pubmed/33919681
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.3390/ijms22084023
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