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University of Delhi Assistant Professor
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Publications (10)
- Density functional theory study of the antioxidant activity of glutathione: Reaction with alloxan and its derivatives Save
- Conceptualizing the Essence of Protein–Ligand Interaction at Undergraduate Level: Reinforcing Computational Skills Save
- A DFT-D2 study on the adsorption of phosgene derivatives and chloromethyl chloroformate on pristine and Fe4-decorated graphene Save
- Adsorption of methyl isocyanate on M4 (M=Fe, Ni, and Cu) cluster-decorated graphene and vacancy graphene: a DFT-D2 study Save
- Structural, electronic, and reactivity parameters of some triorganotin(IV) carboxylates: a DFT analysis Save
- Influence of intrinsic and extrinsic factors on the antiradical activity of Gallic acid: a theoretical study Save
- DFT study of structural and electronic properties of gallic acid and its anions in gas phase and in aqueous solution Save
- In silico studies on potential MCF-7 inhibitors: a combination of pharmacophore and 3D-QSAR modeling, virtual screening, molecular docking, and pharmacokinetic analysis Save
- Gallic acid: a versatile antioxidant with promising therapeutic and industrial applications Save
- Density Functional Study of Functionalization of Carbon Nanotubes with Carbenes Save