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Conformational dynamics of cathepsin D and binding to a small-molecule BACE1 inhibitor

BACE1 is a major therapeutic target for prevention and treatment of Alzheimer’s disease. Developing inhibitors that can selectively target BACE1 in favor of other proteases, especially cathepsin D (CatD), has presented significant challenges. Here we investigate the conformational dynamics and proto...

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Bibliografiska uppgifter
I publikationen:J Comput Chem
Huvudupphovsmän: Ellis, Christopher R., Tsai, Cheng-Chieh, Lin, Fang-Yu, Shen, Jana
Materialtyp: Artigo
Språk:Inglês
Publicerad: 2017
Ämnen:
Länkar:https://ncbi.nlm.nih.gov/pmc/articles/PMC5403572/
https://ncbi.nlm.nih.gov/pubmed/28370344
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1002/jcc.24719
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