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PubPharm (23)
1
Identification of medicinal plant-based phytochemicals as a potential inhibitor for SARS-CoV-2 main protease (Mpro) using molecular docking and deep learning methods
enthalten in:
Computers in biology and medicine
| 2023
von
Hossain, A.
|
Rahman, M.
|
Rahman, M.
| +4
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2
Computational approach investigation bioactive molecules from Saussurea Costus plant as SARS-CoV-2 main protease inhibitors using reverse docking, molecular dynamics simulation, and pharmacokinetic ADMET parameters
enthalten in:
Computers in biology and medicine
| 2022
von
Hajji, H.
|
Alaqarbeh, M.
|
Lakhlifi, T.
| +3
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3
Computational molecular interaction between SARS-CoV-2 main protease and theaflavin digallate using free energy perturbation and molecular dynamics
enthalten in:
Computers in biology and medicine
| 2022
von
Manish, M.
|
Mishra, S.
|
Anand, A.
| +1
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4
Computational exploration of the dual role of the phytochemical fortunellin : Antiviral activities against SARS-CoV-2 and immunomodulatory abilities against the host
enthalten in:
Computers in biology and medicine
| 2022
von
Agrawal, S.
|
Pathak, E.
|
Mishra, R.
| +9
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5
Investigating the structure-activity relationship of marine polycyclic batzelladine alkaloids as promising inhibitors for SARS-CoV-2 main protease (Mpro)
enthalten in:
Computers in biology and medicine
| 2022
von
Elgohary, A.
|
Elfiky, A.
|
Pereira, F.
| +4
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6
De Novo design of potential inhibitors against SARS-CoV-2 Mpro
enthalten in:
Computers in biology and medicine
| 2022
von
Li, S.
|
Wang, L.
|
Meng, J.
| +3
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7
Benchmarking the ability of novel compounds to inhibit SARS-CoV-2 main protease using steered molecular dynamics simulations
enthalten in:
Computers in biology and medicine
| 2022
von
Singh, R.
|
Bhardwaj, V.
|
Das, P.
| +3
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8
Computational investigation of benzalacetophenone derivatives against SARS-CoV-2 as potential multi-target bioactive compounds
enthalten in:
Computers in biology and medicine
| 2022
von
Khanal, P.
|
Patil, V.
|
Bhandare, V.
| +6
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9
Multidimensional in silico strategy for identification of natural polyphenols-based SARS-CoV-2 main protease (Mpro) inhibitors to unveil a hope against COVID-19
enthalten in:
Computers in biology and medicine
| 2022
von
Adem, .
|
Eyupoglu, V.
|
Ibrahim, I.
| +4
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10
Molecular docking-assisted investigation of Pd(II) complexes carrying "SNS" pincer-type pyridine-thioether ligand as potential drug candidates against COVID-19
enthalten in:
Computers in biology and medicine
| 2022
von
Sogukomerogullari, H.
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Zeitschrift: Computers in biology and medicine
Medienart
23
Aufsätze
23
E-Artikel
23
E-Ressourcen
Zeitschriftentitel
Computers in biology and medicine
Thema
23
Journal Article
17
EC 3.4.22.-
17
Protease Inhibitors
16
Coronavirus 3C Proteases
16
EC 3.4.22.28
15
3C-like proteinase, SARS-CoV-2
12
COVID-19
12
SARS-CoV-2
11
Research Support, Non-U.S. Gov't
8
Antiviral Agents
8
Molecular docking
7
Molecular dynamics
5
Main protease
5
Viral Nonstructural Proteins
4
EC 3.4.-
4
EC 3.4.22.2
4
Peptide Hydrolases
3
Cysteine Endopeptidases
3
Molecular dynamics simulation
3
Phytochemicals
Alle anzeigen ...
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Erscheinungszeitraum
1
2023
11
2022
9
2021
2
2020
Erscheinungsjahr(e)
Von:
Bis:
Sprache
23
Englisch
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