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Computational screening of promising beta-secretase 1 inhibitors through multi-step molecular docking and molecular dynamics simulations - pharmacoinformatics approach

Gupta, Shruti; Parihar, Devendra; Shah, Mokshada; Yadav, Shivali; Managori, Husain; Bhowmick, Shovonlal; Patil, Preeti Chunarkar; Alissa, Siham A.; Wabaidur, Saikh Mohammad; Islam, Md Ataul (Elsevier, 2020-04)

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Author
- Alissa, Siham A. (1)
- Bhowmick, Shovonlal (1)
- Gupta, Shruti (1)
- Islam, Md Ataul (1)
- Managori, Husain (1)
- Parihar, Devendra (1)
- Patil, Preeti Chunarkar (1)
- Shah, Mokshada (1)
- Wabaidur, Saikh Mohammad (1)
- Yadav, Shivali (1)
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- Alzheimer’s disease (AD) (1)
- BACE1 (1)
- Beta-secretase enzyme (1)
- Molecular docking (1)
- Molecular dynamics simulations (1)
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