| Anticancer properties, apoptosis and catecholase mimic activities of dinuclear cobalt (II) and copper (II) Schiff base complexes MN Ahamad, K Iman, MK Raza, M Kumar, A Ansari, M Ahmad, M Shahid Bioorganic chemistry 95, 103561, 2020 | 82 | 2020 |
| Comparison of the binding energies of approved mpox drugs and phytochemicals through molecular docking, molecular dynamics simulation, and ADMET studies: An in silico approach RK Mohapatra, A Mahal, A Ansari, M Kumar, JP Guru, AK Sarangi, ... Journal of Biosafety and Biosecurity 5 (3), 118-132, 2023 | 52 | 2023 |
| Structural investigations, Hirsfeld surface analyses, and molecular docking studies of a phenoxo-bridged binuclear Zinc (II) complex M Azam, PK Sahoo, RK Mohapatra, M Kumar, A Ansari, IS Moon, ... Journal of Molecular Structure 1251, 132039, 2022 | 38 | 2022 |
| Synthesis, characterization, theoretical studies and catecholase like activities of [MO 6] type complexes MN Ahamad, M Kumar, A Ansari, I Mantasha, M Ahmad, M Shahid New Journal of Chemistry 43 (35), 14074-14083, 2019 | 30 | 2019 |
| Synthesis, structural investigations, XRD, DFT, anticancer and molecular docking study of a series of thiazole based Schiff base metal complexes RK Al-Shemary, RK Mohapatra, M Kumar, AK Sarangi, M Azam, HS Tuli, ... Journal of Molecular Structure 1275, 134676, 2023 | 26 | 2023 |
| Exploring solvent dependent catecholase activity in transition metal complexes: an experimental and theoretical approach I Mantasha, M Shahid, M Kumar, A Ansari, MN Akhtar, MA AlDamen, ... New Journal of Chemistry 44 (4), 1371-1388, 2020 | 26 | 2020 |
| A combined experimental and theoretical approach to investigate the structure, magnetic properties and DNA binding affinity of a homodinuclear Cu (ii) complex MN Ahamad, M Shahid, A Ansari, M Kumar, IM Khan, M Ahmad, R Arif New Journal of Chemistry 43 (19), 7511-7519, 2019 | 25 | 2019 |
| An efficient synthesis towards the core of Crinipellin: TD-DFT and docking studies R Sahu, RK Mohapatra, SI Al-Resayes, D Das, PK Parhi, S Rahman, ... Journal of Saudi Chemical Society 25 (2), 101193, 2021 | 18 | 2021 |
| Sulfonamide as Photoinduced Hydrogen Atom Transfer Catalyst for Organophotoredox Hydrosilylation and Hydrogermylation of Activated Alkenes K Ram Bajya, M Kumar, A Ansari, S Selvakumar Advanced Synthesis & Catalysis 365 (7), 976-982, 2023 | 16 | 2023 |
| Electronic, geometrical and photophysical facets of five coordinated porphyrin N-heterocyclic carbene transition metals complexes: A theoretical study M Kumar, M Ansari, A Ansari Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy 284, 121774, 2023 | 16 | 2023 |
| Electronic structures and ligand effect on redox potential of iron and cobalt complexes: a computational insight M Kumar, MK Gupta, MA Rizvi, A Ansari Structural Chemistry 34 (4), 1565-1575, 2023 | 9 | 2023 |
| Fabrication of a Cd (ii) metal–organic framework as a dual functional material: efficient iodine capture and selective adsorption of a cationic dye F Vakil, MS Ahmad, M Kumar, A Ansari, M Shahid, M Ahmad CrystEngComm 25 (15), 2280-2297, 2023 | 9 | 2023 |
| Theoretical exploration on structures, bonding aspects and molecular docking of α-aminophosphonate ligated copper complexes against SARS-CoV-2 proteases O Yadav, M Kumar, H Mittal, K Yadav, V Seidel, A Ansari Frontiers in Pharmacology 13, 982484, 2022 | 9 | 2022 |
| Fabrication of Unique Mixed-Valent CoICoII and CuICuII Metal–Organic Frameworks (MOFs) for Desulfurization of Fuels: A Combined Experimental and … HAM Saleh, S Khan, M Kumar, A Ansari, M Shahid, F Sama, KMA Qasem, ... Inorganic Chemistry 63 (1), 329-345, 2023 | 5 | 2023 |
| Photophysical properties of four-membered BN3 heterocyclic compounds: theoretical insights M Kumar, AK Talakkal, RK Mohapatra, A Ansari Journal of Molecular Modeling 29 (11), 336, 2023 | 5 | 2023 |
| Theoretical exploration of copper based electrolytes for third generation dye sensitized solar cells SS Malhotra, M Kumar, MK Gupta, A Ansari Materials Today Communications 39, 109208, 2024 | 4 | 2024 |
| C–H bond activation by high-valent iron/cobalt–oxo complexes: a quantum chemical modeling approach M Kumar, MK Gupta, M Ansari, A Ansari Physical Chemistry Chemical Physics 26 (5), 4349-4362, 2024 | 4 | 2024 |
| Theoretical study of the formation of metal–oxo species of the first transition series with the ligand 14-TMC: driving factors of the “Oxo Wall” M Kumar, A Sarkar, MK Gupta, A Ansari Dalton Transactions 52 (39), 14160-14169, 2023 | 2 | 2023 |
| Unveiling Gelation and Antimicrobial Potentials of α‐Acyloxy Carboxamides: Findings from Experimental and Theoretical Approach S Sebastian, M Kumar, F Hussain, S Rathore, Y Rohila, M Goyat, ... ChemMedChem, e202400774, 2025 | | 2025 |
| Theoretical exploration of a di-carbazole based dye for 3rd generation dye-sensitized solar cells SS Malhotra, M Ahmed, M Kumar, MA Amin, SM El-Bahy, ZM El-Bahy, ... Materials Today Communications 41, 110182, 2024 | | 2024 |
Dr. Azaj AnsariAssistant Professor, Department of Chemistry, Central University of HaryanaBestätigte E-Mail-Adresse bei cuh.ac.in