| In silico investigation of phytoconstituents of medicinal herb ‘Piper Longum’against SARS-CoV-2 by molecular docking and molecular dynamics analysis S Lakhera, K Devlal, A Ghosh, M Rana Results in chemistry 3, 100199, 2021 | 45 | 2021 |
| Modelling the DFT structural and reactivity study of feverfew and evaluation of its potential antiviral activity against COVID-19 using molecular docking and MD simulations S Lakhera, K Devlal, A Ghosh, P Chowdhury, M Rana Chemical Papers 76 (5), 2759-2776, 2022 | 36 | 2022 |
| A comprehensive exploration of pharmacological properties, bioactivities and inhibitory potentiality of luteolin from Tridax procumbens as anticancer drug by in-silico approach S Lakhera, M Rana, K Devlal, I Celik, R Yadav Structural chemistry 33 (3), 703-719, 2022 | 23 | 2022 |
| Study of nonlinear optical responses of phytochemicals of Clitoria ternatea by quantum mechanical approach and investigation of their anti-Alzheimer activity with … S Lakhera, K Devlal, M Rana, I Celik Structural Chemistry 34 (2), 439-454, 2023 | 18 | 2023 |
| Influence of Adsorption of Gold and Silver Nanoclusters on Structural, Electronic, and Nonlinear optical properties of Pentacene-5, 12-dione: A DFT study S Lakhera, M Rana, K Devlal Optical and Quantum Electronics 55 (2), 178, 2023 | 17 | 2023 |
| Quantum mechanical study of three aromatic bioactive fatty alcohol compounds with nonlinear optical and potential light harvesting properties S Lakhera, K Devlal, M Rana, V Dhuliya Optical Materials 129, 112476, 2022 | 16 | 2022 |
| Theoretical study on spectral and optical properties of essential amino acids: a comparative study S Lakhera, M Rana, K Devlal Optical and Quantum Electronics 54 (11), 714, 2022 | 14 | 2022 |
| Computational study of non-linear optical and electrical properties of 1, 3-dinitropyrene S Lakhera, M Rana, K Devlal, V Dhuliya Optical and Quantum Electronics 55 (1), 85, 2023 | 13 | 2023 |
| Photovoltaic characteristics of organic heterocyclic 2, 9-dimethyl quinacridone in different solvents using DFT approach S Lakhera, M Rana, K Devlal, N Kanagathara, J Janczak Journal of Photochemistry and Photobiology A: Chemistry 441, 114664, 2023 | 11 | 2023 |
| Investigation of the electronic and optical activity of halogen-substituted 2-nitrotoulene by density functional theory S Lakhera, M Rana, K Devlal Optical and Quantum Electronics 55 (4), 292, 2023 | 9 | 2023 |
| Investigation of nonlinear optical responses of organic derivative of imidazole: imidazole-2-carboxaldehyde S Lakhera, M Rana, K Devlal International Journal of Materials Research 114 (7-8), 555-563, 2023 | 7 | 2023 |
| Non-linear optical behavior of 2, 9-dimethylquinacridone with adsorbed gold and silver nanoclusters S Lakhera, K Devlal, M Rana, V Dhuliya, N Pandey Optik 286, 170983, 2023 | 7 | 2023 |
| Two-photon absorption and optical limiting in 7-diethylamino-4-methyl coumarin S Lakhera, K Devlal, M Rana, N Kanagathara, A Dhanusha, TCS Girisun, ... Journal of Photochemistry and Photobiology A: Chemistry 447, 115216, 2024 | 3 | 2024 |
| Exploring the Nonlinear optical limiting activity of para-aminobenzoic acid by experimental and Dft approach S Lakhera, M Rana, K Devlal, S Sharma, P Chowdhury, V Dhuliya, ... Journal of Photochemistry and Photobiology A: Chemistry 444, 114987, 2023 | 3 | 2023 |
| Nonlinear optical response of silver trimer adsorbed para-aminobenzoic acid: A DFT study S Lakhera, K Devlal, M Rana Physica Scripta 98 (11), 115519, 2023 | 2 | 2023 |
| Potential natural inhibitors as strong anti‐viral agents: rigid and sequential docking analysis S Lakhera, M Rana, K Devlal Life in Silico 1 (1), 34-47, 2023 | 1 | 2023 |
| Inhibiting Property of Phytoconstituents of ‘Aconitum Heterophyllum’Against Omicron Variant of SARS-CoV-2: Molecular Docking, Molecular Dynamic and MM-GBSA approach S Lakhera, K Devlal, M Rana, A Ghosh | 1 | 2022 |
| Influence of the substitution of different functional groups on the gas sensing and light harvesting efficiency of zero-dimensional coronene quantum dot: A first principle DFT … S Lakhera, K Devlal, M Rana, V Dhuliya Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy 308, 123737, 2024 | | 2024 |
| Comprehensive quantum chemical study of the associative complex of para-aminobenzoic acid and 7-diethylamino 4-methyl coumarin by adsorption and aromatic bridges S Lakhera, M Rana, K Devlal Journal of Molecular Modeling 30 (2), 1-15, 2024 | | 2024 |
| Detailed quantum chemical, ADMET, reactivity, and molecular docking interaction analysis of potential phytochemicals from Asparagus racemosus targeting HIV enzyme/DNA receptors M Rana, S Lakhera, K Devlal Life in Silico 2 (1), 1-16, 2024 | | 2024 |
Dr. Meenakshi RanaUttarakhand Open University, HaldwaniVerified email at uou.ac.in
