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Sequence-based drug-target affinity prediction using weighted graph neural networks
BACKGROUND: Affinity prediction between molecule and protein is an important step of virtual screening, which is usually called drug-target affinity (DTA) prediction. Its accuracy directly influences the progress of drug development. Sequence-based drug-target affinity prediction can predict the aff...
Autores principales: | , , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
BioMed Central
2022
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9205061/ https://www.ncbi.nlm.nih.gov/pubmed/35715739 http://dx.doi.org/10.1186/s12864-022-08648-9 |