Author

Pratyashee Barukial

Institution: Gauhati University

Observed institution: Gauhati University

ORCID: 0000-0002-7445-6612

Observed ORCID: 0000-0002-7445-6612

OpenAlex ID: A5020878699

A comparative DFT study on the π-π stacking interaction of some N-based organic fused heterocycles with eclipsed and staggered conformations

2022 · Ibrahim Ali, Benzir Ahmed, et al. · Journal of the Indian Chemical Society · 10

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

2023 · Pratyashee Barukial, Benzir Ahmed, et al. · Journal of the Indian Chemical Society · 9

Synergistic in silico exploration of some pyrazole-based potential anticancer agents: a DFT, molecular docking, and molecular dynamics study

2025 · Pratyashee Barukial, Rajib Nandi, et al. · Journal of Molecular Modeling · 8

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

2022 · Benzir Ahmed, Pratyashee Barukial, et al. · Journal of the Indian Chemical Society · 5

Computational insights into Ru( ii )–coumarin complexes as potential anticancer agents: a DFT, QTAIM, NCI-RDG, molecular docking and molecular dynamics approach

2025 · Pratyashee Barukial, Rajib Nandi, et al. · Physical Chemistry Chemical Physics · 4

Some halogenated anticancer agents, role of halide (-X) and their interaction mechanism with AT/GC base pairs: A computational study

2023 · Benzir Ahmed, Pratyashee Barukial, et al. · Journal of the Indian Chemical Society · 4

Antioxidant efficacy of hydroxytyrosol, tyrosol, homovanillic alcohol, and their acetate derivatives in Parkinson's disease: A synergistic computational approach

2025 · Rituraj Barman, Benzir Ahmed, et al. · Computers in Biology and Medicine · 3

The 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

2024 · Benzir Ahmed, Bipul Bezbaruah, et al. · Indian Journal of Chemistry · 2

Effect of Polarity on the Interaction Energies of some Organic Solvent (OS)-Water System and Formation of Donor-acceptor Complex: Quantum Mechanical MP4 Study

2022 · Mrinal Jyoti Bezbaruah, Ibrahim A. I. Ali, et al. · Physical chemistry research · 2

In silico exploration of selected coumarin derivatives as potential antioxidant: Insights from DFT, NBO, Hirshfeld surface, ADMET profiling, Molecular docking and Dynamics simulations

2025 · Rituraj Barman, Benzir Ahmed, et al. · Indian Journal of Biochemistry and Biophysics · 1

Author response for "Computational Insights into Ru(II)-Coumarin Complexes as Potential Anticancer Agents: A DFT, QTAIM, NCI-RDG, Molecular Docking and Molecular Dynamics Approach"

2025 · Pratyashee Barukial, Rajib Nandi, et al. · Publons reviews and discussion

Some Co(II)-Schiff base complexes as promising anticancer agents: A DFT and molecular docking study

2024 · Pratyashee Barukial, Benzir Ahmed, et al. · Indian Journal of Biochemistry and Biophysics

DFT STUDY ON THE CONFORMATIONAL CHANGE IN π-π STACKING INTERACTION OF NAPHTHALENE, α - NAPHTHOL AND β-NAPHTHOL SYSTEMS

2022 · Ibrahim Ali, Benzir Ahmed, et al. · RASAYAN Journal of Chemistry

Quantum Mechanical Study of some Intercalating and Groove Binding Anticancer Drugs with AT and GC Base Pair of DNA Nucleobase

2021 · Benzir Ahmed, Bipul Bezbaruah, et al. · Physical chemistry research

Works count: 14

Citation count: 48

H-index: 4

I10-index: 1