| DFT calculations on molecular structures, HOMO–LUMO study, reactivity descriptors and spectral analyses of newly synthesized diorganotin (IV) 2‐chloridophenylacetohydroxamate … VK Choudhary, AK Bhatt, D Dash, N Sharma Journal of computational chemistry 40 (27), 2354-2363, 2019 | 278* | 2019 |
| Density functional theory studies on molecular geometry, spectroscopy, HOMO–LUMO and reactivity descriptors of titanium (IV) and oxidozirconium (IV) complexes of … VK Choudhary, K Mandhan, D Dash, S Bhardwaj, M Kumari, N Sharma Journal of Computational Chemistry 43 (31), 2060-2071, 2022 | 8 | 2022 |
| Experimental and Computational Studies of Chlorido (indole-3-acetohydroxamato) Dimethyltin (IV) Complex: Single Crystal Structure, Biological Evaluation and Molecular Docking Study VK Choudhary, D Dash, M Thakur, M Kumari Journal of Inorganic and Organometallic Polymers and Materials, 1-15, 2024 | | 2024 |
| TMACH-1, 2-HOPO, a versatile tripodal metal chelator: complexation, solution thermodynamics, spectroscopic and DFT studies D Dash, S Singh, M Baral, BK Kanungo Journal of Inclusion Phenomena and Macrocyclic Chemistry 104 (3), 109-127, 2024 | | 2024 |
