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PubPharm (184)
1
A robust computational quest : Discovering potential hits to improve the treatment of pyrazinamide-resistant Mycobacterium tuberculosis
enthalten in:
Journal of cellular and molecular medicine
| 2024
von
Shahab, M.
|
de Farias Morais, G.
|
Akash, S.
| +4
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2
Unraveling the mechanisms of Sofosbuvir resistance in HCV NS3/4A protease : Structural and molecular simulation-based insights
enthalten in:
International journal of biological macromolecules
| 2024
von
Shahab, M.
|
Khan, A.
|
Khan, S.
| +1
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3
Machine learning-based drug design for identification of thymidylate kinase inhibitors as a potential anti-Mycobacterium tuberculosis
enthalten in:
Journal of biomolecular structure & dynamics
| 2024
von
Shahab, M.
|
Danial, M.
|
Duan, X.
| +6
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4
Non-invasive prediction nomogram for predicting significant fibrosis in patients with metabolic-associated fatty liver disease : a cross-sectional study
enthalten in:
Annals of medicine
| 2024
von
Zhang, F.
|
Han, Y.
|
Mao, Y.
| +3
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5
Targeting Human progesterone receptor (PR), through Pharmacophore- based screening and molecular simulation revealed potent inhibitors against breast cancer
enthalten in:
ResearchSquare.com
| 2024
von
Shahab, M.
|
Ziyu, P.
|
Zheng, G.
| +3
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6
Targeting human progesterone receptor (PR), through pharmacophore-based screening and molecular simulation revealed potent inhibitors against breast cancer
enthalten in:
Scientific reports
| 2024
von
Shahab, M.
|
Ziyu, P.
|
Waqas, M.
| +4
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7
Immunoinformatics-driven In silico vaccine design for Nipah virus (NPV) : Integrating machine learning and computational epitope prediction
enthalten in:
Computers in biology and medicine
| 2024
von
Shahab, M.
|
Iqbal, M.
|
Ahmad, A.
| +4
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8
Machine learning and molecular simulation-based protocols to identify novel potential inhibitors for reverse transcriptase against HIV infections
enthalten in:
Journal of biomolecular structure & dynamics
| 2024
von
Shahab, M.
|
Zheng, G.
|
Bin Jardan, Y.
| +1
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9
Design and Synthesis of Immunoadjuvant QS-21 Analogs and Their Biological Evaluation
enthalten in:
Biomedicines
| 2024
von
Yuan, W.
|
Wang, Z.
|
Zou, Y.
| +1
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10
In silico exploration of the potential inhibitory activities of in-house and ZINC database lead compounds against alpha-glucosidase using structure-based virtual screening and molecular dynamics simulation approach
enthalten in:
Journal of biomolecular structure & dynamics
| 2024
von
Awan, Z.
|
Khan, H.
|
Jamal, A.
| +6
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26
Research Support, Non-U.S. Gov't
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Biocatalysis
16
Amidohydrolases
16
EC 3.5.-
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gamma-lactamase
12
Lassomycin
11
(+)-γ-Lactamase
10
Vince lactam
9
MD simulation
8
Anti-TB
8
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8
Lasso peptide
8
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(+)-γ-lactamase
7
Abacavir
7
Molecular docking
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