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/vufind/Search/Results?lookfor=%22Molecular+Dynamics+Simulation%22&type=Subject&filter%5B%5D=topic_facet%3A%22SARS-CoV-2%22
/vufind/Search/Results?lookfor=%22Molecular+Dynamics+Simulation%22&type=Subject&filter%5B%5D=topic_facet%3A%22SARS-CoV-2%22
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PubPharm (419)
1
Computational investigation of the inhibitory interaction of IRF3 and SARS-CoV-2 accessory protein ORF3b
enthalten in:
Biochemical and biophysical research communications
| 2024
von
Bai, G.
|
Zeng, X.
|
Zhang, L.
| +2
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2
Deciphering ACE2-RBD binding affinity through peptide scanning : A molecular dynamics simulation approach
enthalten in:
Computers in biology and medicine
| 2024
von
Tang, J.
|
Hu, R.
|
Liu, Y.
| +8
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3
Identification of Pyrazole Derivatives of Usnic Acid as Novel Inhibitor of SARS-CoV-2 Main Protease Through Virtual Screening Approaches
enthalten in:
Molecular biotechnology
| 2024
von
Roney, M.
|
Singh, G.
|
Huq, A.
| +5
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4
Interaction analysis of SARS-CoV-2 omicron BA1 and BA2 of RBD with fifty monoclonal antibodies : Molecular dynamics approach
enthalten in:
Journal of molecular graphics & modelling
| 2024
von
Sandhya, K.
|
Kishore, A.
|
Unni, A.
| +3
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5
An Approach for Engineering Peptides for Competitive Inhibition of the SARS-COV-2 Spike Protein
enthalten in:
Molecules (Basel, Switzerland)
| 2024
von
de Abreu, A.
|
Carvalho, F.
|
Mariano, D.
| +5
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6
Antiviral peptides inhibiting the main protease of SARS-CoV-2 investigated by computational screening and in vitro protease assay
enthalten in:
Journal of peptide science : an official publication of the European Peptide Society
| 2024
von
Stewart, J.
|
Shawon, J.
|
Ali, M.
| +13
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7
Identification of Phytochemicals from Arabian Peninsula Medicinal Plants as Strong Binders to SARS-CoV-2 Proteases (3CLPro and PLPro) by Molecular Docking and Dynamic Simulation Studies
enthalten in:
Molecules (Basel, Switzerland)
| 2024
von
Saquib, Q.
|
Bakheit, A.
|
Ahmed, S.
| +3
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8
In-silico guided design, screening, and molecular dynamic simulation studies for the identification of potential SARS-CoV-2 main protease inhibitors for the targeted treatment of COVID-19
enthalten in:
Journal of biomolecular structure & dynamics
| 2024
von
Gutti, G.
|
He, Y.
|
Coldren, W.
| +5
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9
Targeting papain-like protease by natural products as novel therapeutic potential SARS-CoV-2
enthalten in:
International journal of biological macromolecules
| 2024
von
Waqas, M.
|
Ullah, S.
|
Halim, S.
| +6
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10
Molecular dynamic analyses of the interaction of SARS-CoV-1 or 2 variants with various angiotensin-converting enzyme-2 species
enthalten in:
Journal of biomolecular structure & dynamics
| 2024
von
Aloufi, A.
|
El-Arabey, A.
|
Eltayb, W.
| +7
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Thema: SARS-CoV-2
Medienart
419
Aufsätze
406
E-Artikel
406
E-Ressourcen
13
Gedruckte Aufsätze
Zeitschriftentitel
63
Journal of biomolecular structure & dynamics
19
Journal of molecular modeling
14
Molecules (Basel, Switzerland)
13
Computers in biology and medicine
13
International journal of molecular sciences
11
Biomolecules
11
International Journal of Molecular Sciences
11
Journal of molecular graphics & modelling
10
Molecules
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3 Biotech
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Computational and structural biotechnology journal
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Viruses
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Journal of molecular structure
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Biologia
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Frontiers in molecular biosciences
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Molecular diversity
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Frontiers in Molecular Biosciences
4
Cell biochemistry and biophysics
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Thema
SARS-CoV-2
290
Journal Article
137
COVID-19
111
molecular dynamics simulation
101
Molecular dynamics simulation
95
Antiviral Agents
76
Research Support, Non-U.S. Gov't
72
molecular docking
70
Molecular docking
64
Spike Glycoprotein, Coronavirus
59
molecular dynamics simulations
58
spike protein, SARS-CoV-2
56
Protease Inhibitors
37
Molecular dynamics simulations
33
Angiotensin-Converting Enzyme 2
33
EC 3.4.17.23
33
EC 3.4.22.-
33
molecular dynamic simulation
32
Coronavirus 3C Proteases
32
EC 3.4.22.28
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Erscheinungszeitraum
20
2024
82
2023
161
2022
121
2021
35
2020
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