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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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書目詳細資料
發表在:PeerJ
Main Authors: Zhang, Haiping, Liao, Linbu, Saravanan, Konda Mani, Yin, Peng, Wei, Yanjie
格式: Artigo
語言:Inglês
出版: PeerJ Inc. 2019
主題:
在線閱讀: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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