Facile synthesis of chalcone derivatives as antibacterial agents: Synthesis, DNA binding, molecular docking, DFT and antioxidant studies R Arif, M Rana, S Yasmeen, MS Khan, M Abid, MS Khan Journal of Molecular Structure 1208, 127905, 2020 | 62 | 2020 |
Pyrazoline analogs as potential anticancer agents and their apoptosis, molecular docking, MD simulation, DNA binding and antioxidant studies M Rana, R Arif, FI Khan, V Maurya, R Singh, MI Faizan, S Yasmeen, ... Bioorganic Chemistry 108, 104665, 2021 | 36 | 2021 |
Design and Synthesis of Carbothioamide/Carboxamide-Based Pyrazoline Analogs as Potential Anticancer Agents: Apoptosis, Molecular Docking, ADME Assay, and DNA Binding Studies M Rana, MI Faizan, SH Dar, T Ahmad, Rahisuddin ACS omega 7 (26), 22639-22656, 2022 | 19 | 2022 |
Binding and thermodynamic study of thalidomide with calf thymus DNA: Spectroscopic and computational approaches S Yasmeen, FA Qais, M Rana, A Islam International Journal of Biological Macromolecules 207, 644-655, 2022 | 18 | 2022 |
Synthesis, characterization, DFT calculation, antifungal, antioxidant, CT-DNA/pBR322 DNA interaction and molecular docking studies of heterocyclic analogs R Mehandi, R Arif, M Rana, S Ahmedi, R Sultana, MS Khan, M Maseet, ... Journal of Molecular Structure 1245, 131248, 2021 | 16 | 2021 |
Schiff base metal complexes as antimicrobial and anticancer agents S Jain, M Rana, R Sultana, R Mehandi, Rahisuddin Polycyclic Aromatic Compounds, 1-56, 2022 | 14 | 2022 |
Synthesis, Single crystal, TD-DFT, Molecular Dynamics Simulation and DNA binding studies of Carbothioamide Analog M Rana, S Ahmedi, A Fatima, S Ahmad, N Siddiqui, K Raza, N Manzoor, ... Journal of Molecular Structure, 135701, 2023 | 13 | 2023 |
Synthesis, spectral characterization of pyrazole derived Schiff base analogs: molecular dynamic simulation, antibacterial and DNA binding studies R Sultana, A Ali, C Twala, R Mehandi, M Rana, D Yameen, M Abid, ... Journal of Biomolecular Structure and Dynamics, 1-28, 2023 | 10 | 2023 |
Design, synthesis, X-ray crystal structures, anticancer, DNA binding, and molecular modelling studies of pyrazole–pyrazoline hybrid derivatives M Rana, H Hungyo, P Parashar, S Ahmad, R Mehandi, V Tandon, K Raza, ... RSC advances 13 (38), 26766-26779, 2023 | 8 | 2023 |
Synthesis, single crystal structure, DNA binding and antioxidant properties of 5-(4-(dimethylamino) phenyl)-3-(thiophen-2-yl)-pyrazoline-1-carbothioamide M Rana, A Fatima, N Siddiqui, SH Dar, S Javed Journal of Molecular Structure 1261, 132950, 2022 | 7 | 2022 |
Oxadiazole Schiff Base as Fe3+ Ion Chemosensor: “Turn-off” Fluorescent, Biological and Computational Studies R Mehandi, R Sultana, S Ahmedi, M Rana, N Manzoor, S Javed, N Nishat Journal of Fluorescence 33 (2), 751-772, 2023 | 5 | 2023 |
Synthesis, crystal structures, biological and thermal decomposition evaluation of homo and heteroleptic Zn (Ⅱ) dithiocarbamate complexes and use of Zn (Ⅱ) dithiocarbamate to … SH Dar, IA Ansari, S Tabrez, M Rana, M Usman, SU Islam, A Rub Polyhedron 208, 115424, 2021 | 5 | 2021 |
Synthesis and spectral studies of Ni (Ⅱ) complexes involving functionalized dithiocarbamates and triphenylphosphine: X-ray crystal structure, thermal stability, Hirshfeld … SH Dar, N Hasan, M Rana, A Fatima, SNS Andrabi, S Ahmedi, N Manzoor, ... Inorganica Chimica Acta 545, 121271, 2023 | 4 | 2023 |
Carbothioamide Based Pyrazoline Derivative: Synthesis, Single Crystal Structure, DFT/TD-DFT, Hirshfeld Surface Analysis and Biological Studies M Rana, A Fatima, N Siddiqui, S Ahmedi, SH Dar, N Manzoor, S Javed, ... Polycyclic Aromatic Compounds, 1-21, 2022 | 3 | 2022 |
Pd-catalyzed synthesis, characterization, and biological evaluations of pyrazole derivatives: DFT, molecular modelling and antioxidant studies R Mehandi, C Twala, A Ali, S Ahmedi, M Rana, R Sultana, N Manzoor, ... Journal of Organometallic Chemistry, 122994, 2023 | 2 | 2023 |
1, 3, 4-oxadiazole derivatives: synthesis, characterization, antifungal activity, DNA binding investigations, TD-DFT calculations, and molecular modelling R Mehandi, C Twala, S Ahmedi, A Fatima, K ul Islam, M Rana, R Sultana, ... Journal of Biomolecular Structure and Dynamics, 1-33, 2023 | 2 | 2023 |
2‐Amino‐5‐substituted‐1, 3, 4‐oxadiazole as chemosensor for Ni (II) ion detection: antifungal, antioxidant, DNA binding, and molecular docking studies R Sultana, R Arif, M Rana, S Ahmedi, R Mehandi, N Manzoor Luminescence 37 (3), 408-421, 2022 | 2 | 2022 |
4-Bromo-1, 8-Naphthalimide derivatives as Antifungal Agents: Synthesis, Characterization, DNA Binding, Molecular docking, Antioxidant and ADMET studies Nouman, M Rana, S Ahmedi, R Arif, N Manzoor, Rahisuddin Polycyclic Aromatic Compounds, 1-25, 2023 | 1 | 2023 |
1, 3, 4-Oxadiazole derivatives as potential antifungal agents: Synthesis, characterization, Ct-DNA binding, molecular docking, and TD-DFT studies R Mehandi, R Sultana, S Ahmedi, A Fatima, K ul Islam, M Rana, ... | 1 | 2023 |
2-hydrazinobenzothiazole based derivatives: Synthesis, characterization, antifungal, DNA binding and molecular modelling approaches M Rana, S Ahmedi, R Mehandi, S Ahmad, T Fatima, K Raza, N Manzoor Journal of Molecular Structure 1308, 138051, 2024 | | 2024 |