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Rakesh Srivastava

Jawaharlal Nehru University

6

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38

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Discovering potential inhibitors against SARS-CoV-2 by targeting Nsp13 Helicase.

2021 Journal of Biomolecular Structure & Dynamics
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Synthetic Tunability and Biophysical Basis for Fabricating Highly Fluorescent and Stable DNA Copper Nanoclusters.

2021 Langmuir
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Virtual Screening and Free Energy Estimation for Identifying Mycobacterium Tuberculosis Flavoenzyme DprE1 Inhibitors

2020 Journal of Molecular Graphics & Modelling
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Calculation of salt-dependent free energy of binding of β-lactoglobulin homodimer formation and mechanism of dimer formation using molecular dynamics simulation and three-dimensional reference interaction site model (3D-RISM): diffuse salt ions and non-polar interactions between the monomers favor the dimer formation

2020 Physical Chemistry Chemical Physics
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Structure-based virtual screening, molecular dynamics simulation and MM-PBSA toward identifying the inhibitors for two-component regulatory system protein NarL of Mycobacterium Tuberculosis

2019 Journal of Biomolecular Structure & Dynamics
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