| Molecular dynamics simulations in drug discovery and pharmaceutical development OMH Salo-Ahen, I Alanko, R Bhadane, AMJJ Bonvin, RV Honorato, ... Processes 9 (1), 71, 2020 | 410 | 2020 |
| Structural elucidation of SARS-CoV-2 vital proteins: Computational methods reveal potential drug candidates against main protease, Nsp12 polymerase and Nsp13 helicase MU Mirza, M Froeyen Journal of pharmaceutical analysis 10 (4), 320-328, 2020 | 308 | 2020 |
| Loss-of-function mutations in ADCY3 cause monogenic severe obesity S Saeed, A Bonnefond, F Tamanini, MU Mirza, J Manzoor, QM Janjua, ... Nature genetics 50 (2), 175-179, 2018 | 187 | 2018 |
| Towards peptide vaccines against Zika virus: Immunoinformatics combined with molecular dynamics simulations to predict antigenic epitopes of Zika viral proteins M Usman Mirza, S Rafique, A Ali, M Munir, N Ikram, A Manan, ... Scientific reports 6 (1), 37313, 2016 | 137 | 2016 |
| Pharmacoinformatics and molecular dynamics simulation studies reveal potential covalent and FDA-approved inhibitors of SARS-CoV-2 main protease 3CLpro MA Alamri, M Tahir ul Qamar, MU Mirza, R Bhadane, SM Alqahtani, ... Journal of Biomolecular Structure and Dynamics 39 (13), 4936-4948, 2021 | 112 | 2021 |
| Designing multi-epitope vaccine against Staphylococcus aureus by employing subtractive proteomics, reverse vaccinology and immuno-informatics approaches MT ul Qamar, S Ahmad, I Fatima, F Ahmad, F Shahid, A Naz, SW Abbasi, ... Computers in Biology and Medicine 132, 104389, 2021 | 101 | 2021 |
| Structure-based virtual screening and molecular docking for the identification of potential multi-targeted inhibitors against breast cancer Z Yousuf, K Iman, N Iftikhar, MU Mirza Breast Cancer: Targets and Therapy, 447-459, 2017 | 68 | 2017 |
| Antigenic peptide prediction from E6 and E7 oncoproteins of HPV types 16 and 18 for therapeutic vaccine design using immunoinformatics and MD simulation analysis B Jabbar, S Rafique, OMH Salo-Ahen, A Ali, M Munir, M Idrees, MU Mirza, ... Frontiers in immunology 9, 3000, 2018 | 66 | 2018 |
| Integrated computational approach for virtual hit identification against ebola viral proteins VP35 and VP40 MU Mirza, N Ikram International journal of molecular sciences 17 (11), 1748, 2016 | 60 | 2016 |
| In Vitro Antidiabetic, Anti-Obesity and Antioxidant Analysis of Ocimum basilicum Aerial Biomass and in Silico Molecular Docking Simulations with Alpha-Amylase … ZI Noor, D Ahmed, HM Rehman, MT Qamar, M Froeyen, S Ahmad, ... Biology 8 (4), 92, 2019 | 56 | 2019 |
| Discovery of human coronaviruses pan-papain-like protease inhibitors using computational approaches MA Alamri, MT ul Qamar, MU Mirza, SM Alqahtani, M Froeyen, LL Chen Journal of pharmaceutical analysis 10 (6), 546-559, 2020 | 52 | 2020 |
| Medicinal plant phytochemicals and their inhibitory activities against pancreatic lipase: molecular docking combined with molecular dynamics simulation approach B Ahmed, U Ali Ashfaq, M Usman Mirza Natural product research 32 (10), 1123-1129, 2018 | 52 | 2018 |
| Development of a novel multi-epitope vaccine against crimean-congo hemorrhagic fever virus: An integrated reverse vaccinology, vaccine informatics and biophysics approach M Tahir Ul Qamar, S Ismail, S Ahmad, MU Mirza, SW Abbasi, UA Ashfaq, ... Frontiers in Immunology 12, 669812, 2021 | 48 | 2021 |
| Perspectives towards antiviral drug discovery against Ebola virus MU Mirza, M Vanmeert, A Ali, K Iman, M Froeyen, M Idrees Journal of medical virology 91 (12), 2029-2048, 2019 | 45 | 2019 |
| Glycyrrhetinic acid and E. resveratroloside act as potential plant derived compounds against dopamine receptor D3 for Parkinson’s disease: a pharmacoinformatics study MU Mirza, AH Mirza, NUH Ghori, S Ferdous Drug design, development and therapy, 187-198, 2014 | 45 | 2014 |
| Identification of novel human USP2 inhibitor and its putative role in treatment of COVID-19 by inhibiting SARS-CoV-2 papain-like (PLpro) protease MU Mirza, S Ahmad, I Abdullah, M Froeyen Computational biology and chemistry 89, 107376, 2020 | 38 | 2020 |
| In silico structural elucidation of RNA-dependent RNA polymerase towards the identification of potential Crimean-Congo Hemorrhagic Fever Virus inhibitors MU Mirza, M Vanmeert, M Froeyen, A Ali, S Rafique, M Idrees Scientific reports 9 (1), 6809, 2019 | 38 | 2019 |
| Inhibition of oncogenic kinases: An in vitro validated computational approach identified potential multi-target anticancer compounds N Ikram, MU Mirza, M Vanmeert, M Froeyen, OMH Salo-Ahen, M Tahir, ... Biomolecules 9 (4), 124, 2019 | 36 | 2019 |
| Rational design of an XNA ligase through docking of unbound nucleic acids to toroidal proteins M Vanmeert, J Razzokov, MU Mirza, SD Weeks, G Schepers, A Bogaerts, ... Nucleic Acids Research 47 (13), 7130-7142, 2019 | 35 | 2019 |
| Quantification of Berberine in Berberis vulgaris L. Root Extract and Its Curative and Prophylactic Role in Cisplatin-Induced In Vivo Toxicity and In Vitro Cytotoxicity S Ahmad, A Hussain, A Hussain, I Abdullah, MS Ali, M Froeyen, MU Mirza Antioxidants 8 (6), 185, 2019 | 33 | 2019 |
mathy froeyenKU LeuvenE-mail megerősítve itt: rega.kuleuven.be
