Asheesh Kumar

Employment

Employment history is unavailable.

Education

• Babasaheb Bhimrao Ambedkar University School for Physical Sciences M.Sc.
  2011 - Present

Projects & Funding

Projects & funding information is unavailable.

Publications (7)

• A quantum mechanical study of compound I (Cpd I) of microperoxidase-5 (MP5) and its reactivity toward styrene
  New Journal of Chemistry 2026 DOI: 10.1039/D5NJ04179A
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• Electric-field-driven selectivity in high-GWP gas adsorption on doped graphene
  2026 DOI: 10.2139/ssrn.7132838
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• Molecular Property Diagnostic Suite for COVID-19 (MPDSCOVID-19): an open-source disease-specific drug discovery portal
  Gigabyte 2024 DOI: 10.46471/gigabyte.114
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• Biotransformation of Bisphenol by Human Cytochrome P450 2C9 Enzymes: A Density Functional Theory Study
  Inorganic Chemistry 2023 DOI: 10.1021/acs.inorgchem.2c03984
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• Interaction of Nucleic Acid Bases (NABs) with Graphene (GR) and Boron Nitride Graphene (BNG)
  Journal of Molecular Structure 2020 DOI: 10.1016/j.molstruc.2020.128889
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• Interaction of modified nucleic bases with graphene and doped graphenes: a DFT study
  Bulletin of Materials Science 2020 DOI: 10.1007/s12034-020-02136-0
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• Assessing therapeutic potential of molecules: molecular property diagnostic suite for tuberculosis $$(\mathbf{MPDS}^{\mathbf{TB}})$$ ( MPDS TB )
  Journal of Chemical Sciences 2017 DOI: 10.1007/s12039-017-1268-4
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