Unveiling a novel transient druggable pocket in BACE-1 through molecular simulations: conformational analysis and binding mode of multisite inhibitors
The critical role of BACE-1 in the formation of neurotoxic ß-amyloid peptides in the brain makes it an attractive target for an efficacious treatment of Alzheimer’s disease. However, the development of clinically useful BACE-1 inhibitors has proven to be extremely challeng- ing. In this study we exa...
| Main Authors: | , , , , |
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| Format: | Article |
| Published: |
Public Library of Science
2017
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| Online Access: | https://eprints.nottingham.ac.uk/42945/ |