Journal of Hazardous Materials (2020) DOI:
Unravelling the distinct surface interactions of modified graphene nanostructures with methylene blue dye through experimental and computational approaches
ChemElectroChem (2019) DOI:
Exploring battery type ZnO/ZnFe2O4 spheres-3D graphene electrode for supercapacitor: Advantage of yolk-shell over solid structure
Computational and Theoretical Chemistry (2019) DOI:
Probing the catalytic activity of pristine and doped Pd and Ni metal clusters towards H2O molecule
ACS Appl. Bio. Mater. (2019) DOI:
Graphene Oxide Supported Liposomes as Red Emissive Theranostics for Phototriggered Tissue Visualization and Tumor Regression
Bioconjugate Chemistry (2018) DOI: 10.1021/acs.bioconjchem.8b00522
In Vivo Examination of Folic Acid-Conjugated Gold-Silica Nanohybrids as Contrast Agents for Localized Tumor Diagnosis and Biodistribution
Physical Chemistry Chemical Physics, (2018) DOI: 10.1039/C8CP05711G
Dissociative Chemisorption of Hydrogen Molecule on Defective Graphene Supported Aluminium Clusters: A Computational Study
Bioconjugate Chemistry (2018) DOI: 10.1021/acs.bioconjchem.7b00801
Disintegrable NIR Light Triggered Gold Nanorods Supported Liposomal Nanohybrids for Cancer Theranostics
New Journal of Chemistry (2017) DOI:  10.1039/c7nj01461a
A redox-mediated 3D graphene based nanoscoop design for ultracapacitor applications
Nanoscale., (2016), DOI:10.1039/c5nr06756a.
Bioresponsive carbon nano-gated multifunctional mesoporous silica for cancer theranostics
Nanoscale., (2015), DOI:10.1039/C5NR05715a.
Non-templated ambient nanoperforation of graphene: A novel scalable process and its exploitation for energy and environmental applications
Molecular Simulations., (2015), DOI:10.1080/08927022.2015.1067368.
A DFT based assay for tailor-made terpyridine ligand–metal complexation properties
Journal of American Chemical Society., (2011), DOI:10.1021/ja201002r.
Atomic investigation of a bio-Inorganic interface by combining solid state NMR and first principles calculations
Microporous & Mesoporous Materials., (2010), DOI:10.1016/j.micromeso.2010.06.014.
Transformation of chemically fine tuned zeolite A precursor into dense lithium aluminosilicates – A comprehensive phase evolution and sintering study
Microporous & Mesoporous Materials., (2009), DOI:10.1016/j.micromeso.2009.02.022.
Dependence of 29Si NMR chemical shielding properties of precursor silicate species, Q0 on its local structure at the pre-nucleation stages of zeolite synthesis –  A DFT based computational correlation