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PubPharm (52)
1
Immune targeting of filarial glutaredoxin through a multi-epitope peptide-based vaccine : A reverse vaccinology approach
enthalten in:
International immunopharmacology
| 2024
von
Das, N.
|
Gorai, S.
|
Gupta, P.
| +3
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2
Critical assessment of interactions between ct-DNA and choline-based magnetic ionic liquids : evidences of compaction
enthalten in:
Chemical science
| 2024
von
Tulsiyan, K.
|
Panda, S.
|
Rana, M.
| +1
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3
Can Duvelisib and Eganelisib work for both cancer and COVID-19? Molecular-level insights from MD simulations and enhanced samplings
enthalten in:
Physical chemistry chemical physics : PCCP
| 2024
von
Panda, S.
|
Karmakar, S.
|
Sen Gupta, P.
| +1
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4
In silico evaluation of S-adenosyl-L-homocysteine analogs as inhibitors of nsp14-viral cap N7 methyltranferase and PLpro of SARS-CoV-2 : synthesis, molecular docking, physicochemical data, ADMET and molecular dynamics simulations studies
enthalten in:
Journal of biomolecular structure & dynamics
| 2023
von
Srivastava, R.
|
Panda, S.
|
Sen Gupta, P.
| +7
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5
Unmasking an Allosteric Binding Site of the Papain-like Protease in SARS-CoV-2 : Molecular Dynamics Simulations of Corticosteroids
enthalten in:
The journal of physical chemistry letters
| 2023
von
Panda, S.
|
Sen Gupta, P.
|
Karmakar, S.
| +3
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6
Exploring antiviral potency of N-1 substituted pyrimidines against HIV-1 and other DNA/RNA viruses : Design, synthesis, characterization, ADMET analysis, docking, molecular dynamics and biological activity
enthalten in:
Computational biology and chemistry
| 2023
von
Srivastava, R.
|
Gupta, S.
|
Naaz, F.
| +9
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7
Insights into the Binding Mechanism of Ascorbic Acid and Violaxanthin with Violaxanthin De-Epoxidase (VDE) and Chlorophycean Violaxanthin De-Epoxidase (CVDE) Enzymes: Docking, Molecular Dynamics, and Free Energy Analysis
enthalten in:
bioRxiv.org
| 2023
von
Biswal, S.
|
Sen Gupta, P.
|
Bhat, H.
| +1
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8
Hydroxyalkynyl uracil derivatives as NNRTIs against HIV-1 : in silico predictions, synthesis, docking and molecular dynamics simulation studies
enthalten in:
Journal of biomolecular structure & dynamics
| 2023
von
Yadav, M.
|
Srivastava, R.
|
Naaz, F.
| +4
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9
Design, synthesis, antimicrobial activity, DFT, and molecular docking studies of pyridine-pyrazole-based dihydro-1,3,4-oxadiazoles against various bacterial and fungal targets
enthalten in:
Journal of biochemical and molecular toxicology
| 2023
von
Desai, N.
|
Jadeja, D.
|
Monapara, J.
| +3
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10
Insights into the binding mechanism of ascorbic acid and violaxanthin with violaxanthin de-epoxidase (VDE) and chlorophycean violaxanthin de-epoxidase (CVDE) enzymes
enthalten in:
Photosynthesis research
| 2023
von
Biswal, S.
|
Gupta, P.
|
Panda, S.
| +2
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chemRxiv.org
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Chemistry – A European Journal
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Infection, genetics and evolution : journal of ...
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International immunopharmacology
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Thema
32
Journal Article
5
Antiviral Agents
5
molecular docking
4
540
4
COVID-19
4
Chemistry
4
Molecular dynamics
4
Research Support, Non-U.S. Gov't
4
SARS-CoV-2
4
molecular dynamics
3
HIV
3
MD simulation
3
Pharmaceutical Preparations
3
Reverse Transcriptase Inhibitors
3
TLR4
2
Coronavirus 3C Proteases
2
Cystatins
2
DFT
2
Docking
2
EC 2.7.7.49
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Erscheinungszeitraum
35
2020-
17
2010-2019
Erscheinungsjahr(e)
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Sprache
41
Englisch
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