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GraphscoreDTA: optimized graph neural network for protein–ligand binding affinity prediction
MOTIVATION: Computational approaches for identifying the protein–ligand binding affinity can greatly facilitate drug discovery and development. At present, many deep learning-based models are proposed to predict the protein–ligand binding affinity and achieve significant performance improvement. How...
| Autores principales: | , , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
Oxford University Press
2023
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| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10243863/ https://www.ncbi.nlm.nih.gov/pubmed/37225408 http://dx.doi.org/10.1093/bioinformatics/btad340 |