| Mental health research in the lower-middle-income countries of Africa and Asia during the COVID-19 pandemic: a scoping review SK Kar, TP Oyetunji, AJ Prakash, OA Ogunmola, S Tripathy, MM Lawal, ... Neurology, Psychiatry and Brain Research 38, 54-64, 2020 | 55 | 2020 |
| Computational modelling of potent β-secretase (BACE1) inhibitors towards Alzheimer's disease treatment SC Ugbaja, ZK Sanusi, P Appiah-Kubi, MM Lawal, HM Kumalo Biophysical Chemistry 270, 106536, 2021 | 17 | 2021 |
| LoopGrafter: a web tool for transplanting dynamical loops for protein engineering J Planas-Iglesias, F Opaleny, P Ulbrich, J Stourac, Z Sanusi, GP Pinto, ... Nucleic Acids Research 50 (W1), W465-W473, 2022 | 14 | 2022 |
| From recognition to reaction mechanism: an overview on the interactions between HIV-1 protease and its natural targets MM Lawal, ZK Sanusi, T Govender, GEM Maguire, B Honarparvar, ... Current Medicinal Chemistry 27 (15), 2514-2549, 2020 | 14 | 2020 |
| Unraveling the concerted catalytic mechanism of the human immunodeficiency virus type 1 (HIV-1) protease: a hybrid QM/MM study MM Lawal, ZK Sanusi, T Govender, GF Tolufashe, GEM Maguire, ... Structural Chemistry 30, 409-417, 2019 | 14 | 2019 |
| Investigation of the binding free energies of FDA approved drugs against subtype B and C-SA HIV PR: ONIOM approach ZK Sanusi, T Govender, GEM Maguire, SB Maseko, J Lin, HG Kruger, ... Journal of Molecular Graphics and Modelling 76, 77-85, 2017 | 13 | 2017 |
| An insight to the molecular interactions of the FDA approved HIV PR drugs against L38L↑ N↑ L PR mutant ZK Sanusi, T Govender, GEM Maguire, SB Maseko, J Lin, HG Kruger, ... Journal of Computer-Aided Molecular Design 32, 459-471, 2018 | 12 | 2018 |
| Concerted hydrolysis mechanism of HIV-1 natural substrate against subtypes B and C-SA PR: Insight through molecular dynamics and hybrid QM/MM studies ZK Sanusi, MM Lawal, T Govender, S Baijnath, T Naicker, GEM Maguire, ... Physical Chemistry Chemical Physics 22 (4), 2530-2539, 2020 | 11 | 2020 |
| Exploring the concerted mechanistic pathway for HIV-1 PR—substrate revealed by umbrella sampling simulation ZK Sanusi, MM Lawal, PL Gupta, T Govender, S Baijnath, T Naicker, ... Journal of Biomolecular Structure and Dynamics 40 (4), 1736-1747, 2022 | 6 | 2022 |
| Theoretical model for HIV-1 PR that accounts for substrate recognition and preferential cleavage of natural substrates ZK Sanusi, MM Lawal, T Govender, GEM Maguire, B Honarparvar, ... The Journal of Physical Chemistry B 123 (30), 6389-6400, 2019 | 5 | 2019 |
| Effects of Alzheimer’s Disease Drug Candidates on Disordered Aβ42 Dissected by Comparative Markov State Analysis (CoVAMPnet) SM Marques, P Kouba, A Legrand, J Sedlar, L Disson, J Planas-Iglesias, ... bioRxiv, 2023.01. 06.523007, 2023 | 3 | 2023 |
| Insights into the Dynamics and Binding of Two Polyprotein Substrate Cleavage Points in the Context of the SARS-CoV-2 Main and Papain-like Proteases ZK Sanusi, KA Lobb Molecules 27 (23), 8251, 2022 | 2 | 2022 |
| Molecular Analysis of Potential Inhibitors Against SARS-CoV-2: Computational Approach C Ibeji, GF Tolufashe, Z Sanusi, TP Omayone Physical Chemistry Research 11 (4), 725-734, 2023 | | 2023 |
| Nástroj LoopGrafter J Planas Iglesias, F Opálený, P Ulbrich, J Štourač, ZK Sanusi, ... | | 2022 |
| The mechanistic modelling of HIV-1 protease and its natural substrates: a theoretical perspective. ZK Sanusi | | 2020 |
| Computational chemistry studies of subtypes B and South African C HIV proteases. ZK Sanusi | | 2016 |
