Covalent Versus Non-covalent Enzyme Inhibition: Which Route Should We Take? A Justification of the Good and Bad from Molecular Modelling Perspective von Aljoundi, Aimen, Bjij, Imane, El Rashedy, Ahmed, Soliman, Mahmoud E. S.

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Unveiling therapeutic frontiers: DON/DRP-104 as innovative Plasma kallikrein inhibitors against carcinoma-associated hereditary angioedema shocks - a comprehensive molecular dynami... von Oduro-Kwateng, Ernest, Soliman, Mahmoud E. S.

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Integrated Approach to Structure-Based Enzymatic Drug Design: Molecular Modeling, Spectroscopy, and Experimental Bioactivity von Honarparvar, Bahareh, Govender, Thavendran, Maguire, Glenn E. M, Soliman, Mahmoud E. S, Kruger, Hendrik G

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Repurposing of drug candidates against Epstein-Barr virus: Virtual screening, docking computations, molecular dynamics, and quantum mechanical study von Ibrahim, Mahmoud A A, Hassan, Alaa M A, Mohamed, Eslam A R, Mekhemer, Gamal A H, Sidhom, Peter A, El-Tayeb, Mohamed A, Khan, Shahzeb, Shoeib, Tamer, Soliman, Mahmoud E S, Abdelrahman, Alaa H M

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An Update on the Pharmacological Usage of Curcumin: Has it Failed in the Drug Discovery Pipeline? von Olotu, Fisayo, Agoni, Clement, Soremekun, Opeyemi, Soliman, Mahmoud E. S.

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Pharmacophore-Based 3D-QSAR Analysis of Thienyl Chalcones as a New Class of Human MAO‑B Inhibitors: Investigation of Combined Quantum Chemical and Molecular Dynamics Approach von Mathew, Bijo, Adeniyi, Adebayo A, Dev, Sanal, Joy, Monu, Ucar, Gülberk, Mathew, Githa Elizabeth, Singh-Pillay, Ashona, Soliman, Mahmoud E. S

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Antibiotic resistance: bioinformatics-based understanding as a functional strategy for drug design von Ndagi, Umar, Falaki, Abubakar A, Abdullahi, Maryam, Lawal, Monsurat M, Soliman, Mahmoud E

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Glioma-Targeted Therapeutics: Computer-Aided Drug Design Prospective von Poonan, Preantha, Agoni, Clement, Ibrahim, Mahmoud A. A., Soliman, Mahmoud E. S.

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Multi-catalytic Sites Inhibition of Bcl2 Induces Expanding of Hydrophobic Groove: A New Avenue Towards Waldenström Macroglobulinemia Therapy von Elamin, Ghazi, Aljoundi, Aimen, Soliman, Mahmoud E. S.

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The Unusual Architecture of RNA-Dependent RNA Polymerase (RdRp)'s Catalytic Chamber Provides a Potential Strategy for Combination Therapy against COVID-19 von Metwally, Kamel, Abo-Dya, Nader E, Alahmdi, Mohammed Issa, Albalawi, Maha Z, Yahya, Galal, Aljoundi, Aimen, Salifu, Elliasu Y, Elamin, Ghazi, Ibrahim, Mahmoud A A, Sayed, Yasien, Fanucchi, Sylvia, Soliman, Mahmoud E S

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Targeting HCV polymerase: a structural and dynamic perspective into the mechanism of selective covalent inhibition von Shunmugam, Letitia, Soliman, Mahmoud E. S

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Unravelling the Structural Mechanism of Action of 5-methyl-5-[4-(4-oxo-3H-quinazolin-2-yl)phenyl]imidazolidine-2,4-dione in Dual-Targeting Tankyrase 1 and 2: A Novel Avenue in Canc... von Peters, Xylia Q., Agoni, Clement, Soliman, Mahmoud E. S.

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Theory and applications of covalent docking in drug discovery: merits and pitfalls von Kumalo, Hezekiel Mathambo, Bhakat, Soumendranath, Soliman, Mahmoud E S

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Selective SIRT2 inhibitors as promising anticancer therapeutics: An update from 2016 to 2020 von Roshdy, Eslam, Mustafa, Muhamad, Shaltout, Abd El-Rahman, Radwan, Mohamed O., Ibrahim, Mahmoud A.A., Soliman, Mahmoud E., Fujita, Mikako, Otsuka, Masami, Ali, Taha F.S.

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Bridging the Gap in Malaria Parasite Resistance, Current Interventions, and the Way Forward from in Silico Perspective: A Review von Kumi, Ransford Oduro, Oti, Belinda, Abo-Dya, Nader E, Alahmdi, Mohamed Issa, Soliman, Mahmoud E S

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Helichrysum populifolium Compounds Inhibit MtrCDE Efflux Pump Transport Protein for the Potential Management of Gonorrhoea Infection von Mulaudzi, Vhangani E, Adeosun, Idowu J, Adewumi, Adeniyi T, Soliman, Mahmoud E S, Cosa, Sekelwa

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Intermolecular And Dynamic Investigation of The Mechanism of Action of Reldesemtiv on Fast Skeletal Muscle Troponin Complex Toward the Treatment of Impaired Muscle Function von Issahaku, Abdul Rashid, Ibrahim, Mahmoud A. A., Mukelabai, Namutula, Soliman, Mahmoud E. S.

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Allosteric inhibition induces an open WPD-loop: a new avenue towards glioblastoma therapy von Agoni, Clement, Ramharack, Pritika, Soliman, Mahmoud E. S

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Thompson loop: opportunities for antitubercular drug design by targeting the weak spot in demethylmenaquinone methyltransferase protein von Adewumi, Adeniyi T, Soremekun, Opeyemi S, Ajadi, Mary B, Soliman, Mahmoud E. S

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Probing the Highly Disparate Dual Inhibitory Mechanisms of Novel Quinazoline Derivatives against Mycobacterium tuberculosis Protein Kinases A and B von Olotu, Fisayo A, Soliman, Mahmoud E

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