The charge transfer limit of a chemical adduct: the role of perturbation on external potential A Hamid, A Anand, RK Roy Physical Chemistry Chemical Physics 19 (17), 10905-10912, 2017 | 14 | 2017 |
Solvent effect on stabilization energy: An approach based on density functional reactivity theory A Hamid, RK Roy International Journal of Quantum Chemistry 119 (11), e25909, 2019 | 13 | 2019 |
Synthesis, crystallographic study, molecular docking, ADMET, DFT and biological evaluation of new series of aurone derivatives as anti-leishmanial agents SA Nabi, F Ramzan, MS Lone, MA Beg, A Hamid, LM Nainwal, M Samim, ... Journal of Molecular Structure 1256, 132528, 2022 | 10 | 2022 |
Correlation between equilibrium constant and stabilization energy: a combined approach based on chemical thermodynamics, statistical thermodynamics, and density functional … A Hamid, RK Roy The Journal of Physical Chemistry A 124 (7), 1279-1288, 2020 | 9 | 2020 |
Validation of Hammett’s linear free energy relationship through an unconventional approach A Hamid, RK Roy The Journal of Physical Chemistry A 124 (28), 5775-5783, 2020 | 5 | 2020 |
Components of density functional reactivity theory-based stabilization energy: descriptors for thermodynamic and kinetic reactivity A Hamid, N Deswal, S Pal, RK Roy Chemical Reactivity, 181-226, 2023 | 1 | 2023 |
Synthesis, biological evaluation and theoretical studies of (E)-1-(4-sulfamoyl-phenylethyl)-3-arylidene-5-aryl-1H-pyrrol-2(3H)-ones as human carbonic anhydrase … F Ramzan, SA Nabi, MS Lone, A Bonardi, A Hamid, S Bano, K Sharma, ... Journal of Enzyme Inhibition and Medicinal Chemistry 38 (1), 2189126, 2023 | | 2023 |
Halogen substituted aurones as potential apoptotic agents: synthesis, anticancer evaluation, molecular docking, ADMET and DFT study SA Nabi, F Ramzan, MS Lone, LM Nainwal, A Hamid, F Batool, M Husain, ... Journal of Biomolecular Structure and Dynamics, 1-18, 2023 | | 2023 |
Understanding the components of density functional reactivity theory (DFRT) based stabilization energy and related applications A Hamid Birla Institute of Technology and Science, 2022 | | 2022 |