PB
Pratyashee Barukial
Gauhati University, University of Science and Technology, Meghalaya, Dibrugarh University
Research areas: Medicine · Oncology · Metal complexes synthesis and properties · Computational Drug Discovery Methods · DNA and Nucleic Acid Chemistry
0000-0002-7445-6612
Employment
Employment history is unavailable.
Education
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Gauhati University Ph.D.2021 - 2026
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University of Science and Technology, Meghalaya Masters in Chemistry2017 - 2019
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Dibrugarh University Bachelor of Science2014 - 2017
Projects & Funding
Projects & funding information is unavailable.
Publications (17)
- Computational insights into Ru(ii)–coumarin complexes as potential anticancer agents: a DFT, QTAIM, NCI-RDG, molecular docking and molecular dynamics approach Save
- The Role of Pt(dpb)Cl in Targeted Cancer Therapy: A Molecular and Computational Study Save
- Antioxidant efficacy of hydroxytyrosol, tyrosol, homovanillic alcohol, and their acetate derivatives in Parkinson's disease: A synergistic computational approach Save
- In silico exploration of selected coumarin derivatives as potential antioxidant: Insights from DFT, NBO, Hirshfeld surface, ADMET profiling, Molecular docking and Dynamics simulations Save
- Synergistic in silico exploration of some pyrazole-based potential anticancer agents: a DFT, molecular docking, and molecular dynamics study Save
- Some Co(II)-Schiff base complexes as promising anticancer agents: A DFT and molecular docking study Save
- Some Co(Ii) Metal Complexes with Schiff Base Ligands as Potential Anticancer Agents: Dft Computation, Non-Covalent Interaction, Molecular Docking and Admet Studies Save
- Some pyridyl moiety based metal complexes (viz., Mn+2, Co+2 and Zn+2) as potential anticancer agents and DNA nucleobase interaction: A DFT approach Save
- DFT Study on the Carcinogenicity of some Common Polycyclic Aromatic Hydrocarbons (PAH) Save
- Some Pt(II)-complexes with dpb, Fdpb and F2dpb ligands as potent anticancer agents and their mode of interaction with AT/GC base pairs: A DFT study Save
- Some halogenated anticancer agents, role of halide (-X) and their interaction mechanism with AT/GC base pairs: A computational study Save
- A comparative DFT study of some N-based aromatic ligand metal complexes as anticancer agents and analysis of their mode of interaction with DNA base pair Save
- A comparative DFT study on the π-π stacking interaction of some N-based organic fused heterocycles with eclipsed and staggered conformations Save
- DFT STUDY ON THE CONFORMATIONAL CHANGE IN π-π STACKING INTERACTION OF NAPHTHALENE, α-NAPHTHOL AND β-NAPHTHOL SYSTEMS Save
- Effect of Polarity on the Interaction Energies of some Organic Solvent (OS)-Water System and Formation of Donor-acceptor Complex: Quantum Mechanical MP4 Study Save
- Physicochemical Properties and Structural Analysis of Some Organic Solvent (OS)- Water Systems: A Quantum Mechanical Study Save
- Quantum Mechanical Study of some Intercalating and Groove Binding Anticancer Drugs with AT and GC Base Pair of DNA Nucleobase Save