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Debashree Chakraborty

National Institute of Technology, Karnataka

30

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264

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Temperature-Dependent Conformational Evolution of SARS CoV-2 RNA Genome Using Network Analysis.

2021 Journal of Physical Chemistry B
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Diverse interactions of aggregated insulin with selected coumarin dyes: Time dependent fluorogenicity, simulation studies and comparison with thioflavin T

2021 Dyes and Pigments
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Exploring the potential role of quercetin in corrosion inhibition of aluminium alloy 6063 in hydrochloric acid solution by experimental and theoretical studies

2021 Journal of Adhesion Science and Technology
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Theoretical insights into molecular mechanism and energy criteria of PARP-2 enzyme inhibition by benzimidazole analogues.

2021 Proteins
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Effective inhibition of mild steel corrosion by 6-bromo-(2,4-dimethoxyphenyl)methylidene]imidazo [1,2-a]pyridine-2-carbohydrazide in 0.5 M HCl: Insights from experimental and computational study

2021 Journal of Molecular Structure
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Molecular mechanism of inhibition of COVID-19 main protease by β-adrenoceptor agonists and adenosine deaminase inhibitors using in silico methods.

2021 Journal of Biomolecular Structure & Dynamics
- Pushyaraga P. Venugopal
- Debashree Chakraborty
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Epitope-Based Potential Vaccine Candidate for Humoral and Cell-Mediated Immunity to Combat Severe Acute Respiratory Syndrome Coronavirus 2 Pandemic.

2020 Journal of Physical Chemistry Letters
- Bratin Kumar Das
- Debashree Chakraborty
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Structural and dynamical properties of water in surfactant-like peptide-based nanotubes: Effect of pore size, tube length and charge

2020 Journal of Molecular Liquids
- H.N. Dilip
- Debashree Chakraborty
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In-silico epitope identification and design of Uricase mutein with reduced immunogenicity

2020 Process Biochemistry
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Computational insights into factor affecting the potency of diaryl sulfone analogs as Escherichia coli dihydropteroate synthase inhibitors

2019 Computational Biology and Chemistry
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