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DeepBindRG: a deep learning based method for estimating effective protein–ligand affinity

Proteins interact with small molecules to modulate several important cellular functions. Many acute diseases were cured by small molecule binding in the active site of protein either by inhibition or activation. Currently, there are several docking programs to estimate the binding position and the b...

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Detalhes bibliográficos
Publicado no:PeerJ
Main Authors: Zhang, Haiping, Liao, Linbu, Saravanan, Konda Mani, Yin, Peng, Wei, Yanjie
Formato: Artigo
Idioma:Inglês
Publicado em: PeerJ Inc. 2019
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC6661145/
https://ncbi.nlm.nih.gov/pubmed/31380152
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.7717/peerj.7362
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