| Molecular mechanical study of halogen bonding in drug discovery MAA Ibrahim Journal of computational chemistry 32 (12), 2564-2574, 2011 | 235 | 2011 |
| In silico drug discovery of major metabolites from spices as SARS-CoV-2 main protease inhibitors MAA Ibrahim, AHM Abdelrahman, TA Hussien, EAA Badr, TA Mohamed, ... Computers in Biology and Medicine 126, 104046, 2020 | 127 | 2020 |
| Natural-like products as potential SARS-CoV-2 Mpro inhibitors: in-silico drug discovery MAA Ibrahim, KAA Abdeljawaad, AHM Abdelrahman, MEF Hegazy Journal of Biomolecular Structure and Dynamics 39 (15), 5722-5734, 2021 | 93 | 2021 |
| Molecular mechanical perspective on halogen bonding MAA Ibrahim Journal of molecular modeling 18, 4625-4638, 2012 | 83 | 2012 |
| AMBER empirical potential describes the geometry and energy of noncovalent halogen interactions better than advanced semiempirical quantum mechanical method PM6-DH2X MAA Ibrahim The Journal of Physical Chemistry B 116 (11), 3659-3669, 2012 | 77 | 2012 |
| Repurposing of FDA-approved antivirals, antibiotics, anthelmintics, antioxidants, and cell protectives against SARS-CoV-2 papain-like protease M Kandeel, AHM Abdelrahman, K Oh-Hashi, A Ibrahim, KN Venugopala, ... Journal of Biomolecular Structure and Dynamics 39 (14), 5129-5136, 2021 | 76 | 2021 |
| Mortality from gastrointestinal congenital anomalies at 264 hospitals in 74 low-income, middle-income, and high-income countries: a multicentre, international, prospective … NJ Wright, AJM Leather, N Ade-Ajayi, N Sevdalis, J Davies, D Poenaru, ... The Lancet 398 (10297), 325-339, 2021 | 73 | 2021 |
| Anti-viral and immunomodulatory properties of propolis: Chemical diversity, pharmacological properties, preclinical and clinical applications, and in silico potential against … N Yosri, AA Abd El-Wahed, R Ghonaim, OM Khattab, A Sabry, ... Foods 10 (8), 1776, 2021 | 68 | 2021 |
| Rutin and flavone analogs as prospective SARS-CoV-2 main protease inhibitors: In silico drug discovery study MAA Ibrahim, EAR Mohamed, AHM Abdelrahman, KS Allemailem, ... Journal of Molecular Graphics and Modelling 105, 107904, 2021 | 57 | 2021 |
| Muhammad F Amin, MAA Ibrahim, S Rizwan-Ul-Hasan, S Khaliq, GA Gabr Khan, A, 2013 | 57 | 2013 |
| Synthesis, antiproliferative, anti-tubulin activity, and docking study of new 1, 2, 4-triazoles as potential combretastatin analogues M Mustafa, D Abdelhamid, ESMN Abdelhafez, MAA Ibrahim, ... European journal of medicinal chemistry 141, 293-305, 2017 | 55 | 2017 |
| In-silico drug repurposing and molecular dynamics puzzled out potential SARS-CoV-2 main protease inhibitors MAA Ibrahim, AHM Abdelrahman, MEF Hegazy Journal of biomolecular Structure and Dynamics 39 (15), 5756-5767, 2021 | 54 | 2021 |
| In silico evaluation of prospective anti-COVID-19 drug candidates as potential SARS-CoV-2 main protease inhibitors MAA Ibrahim, AHM Abdelrahman, KS Allemailem, A Almatroudi, ... The Protein Journal 40, 296-309, 2021 | 54 | 2021 |
| Cembrene Diterpenoids with Ether Linkages from Sarcophyton ehrenbergi: An Anti-Proliferation and Molecular-Docking Assessment MEF Hegazy, AI Elshamy, TA Mohamed, AR Hamed, MAA Ibrahim, ... Marine Drugs 15 (6), 192, 2017 | 48 | 2017 |
| Structural insights into the South African HIV-1 subtype C protease: impact of hinge region dynamics and flap flexibility in drug resistance P Naicker, I Achilonu, S Fanucchi, M Fernandes, MAA Ibrahim, HW Dirr, ... Journal of Biomolecular Structure and Dynamics 31 (12), 1370-1380, 2013 | 48 | 2013 |
| Comparison of the molecular dynamics and calculated binding free energies for nine FDA‐approved HIV‐1 PR drugs against subtype B and C‐SA HIV PR SM Ahmed, HG Kruger, T Govender, GEM Maguire, Y Sayed, ... Chemical biology & drug design 81 (2), 208-218, 2013 | 47 | 2013 |
| Comparison between fuzzy and P&O control for MPPT for photovoltaic system using boost converter HEA Ibrahim, M Ibrahim Journal of Energy Technologies and Policy 2 (6), 1-11, 2012 | 47 | 2012 |
| In Silico Mining of Terpenes from Red-Sea Invertebrates for SARS-CoV-2 Main Protease (Mpro) Inhibitors MAA Ibrahim, AHM Abdelrahman, TA Mohamed, MAM Atia, ... Molecules 26 (7), 2082, 2021 | 46 | 2021 |
| Graphene and graphene oxide as adsorbents for cadmium and lead heavy metals: A theoretical investigation SM Elgengehi, S El-Taher, MAA Ibrahim, JK Desmarais, KE El-Kelany Applied Surface Science 507, 145038, 2020 | 45 | 2020 |
| Unconventional type III halogen··· halogen interactions: A quantum mechanical elucidation of σ-hole··· σ-hole and di-σ-hole interactions MAA Ibrahim, NAM Moussa ACS omega 5 (34), 21824-21835, 2020 | 42 | 2020 |
