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  1. Dual inhibition of AChE and GSK-3β by flavonoids of Bergenia ciliata: Molecular dynamics insights into anti-Alzheimer’s activity

    Article • Computational Biology and Chemistry, June 2026, Elsevier

    Mohnad Abdalla

  2. Assessment of Bioactive Compounds from Aerial Part of Andrographis paniculata against Bacteria Involved in Urinary Tract Infection and Glucosamine-6-phosphate Synthase (2VF5) of E. coli: in vitro and in silico Study

    Article • Asian Journal of Chemistry, May 2026, Asian Journal of Chemistry

    Mohnad Abdalla

  3. Comparative molecular dynamics reveal ligand-dependent structural and dynamic determinants of dipeptidyl peptidase IV recognition and inhibition

    Article • Journal of Biomolecular Structure and Dynamics, May 2026, Taylor & Francis

    Mohnad Abdalla

  4. In silico investigation of 4-(Trifluoromethyl)benzohydrazide derivatives as potential anti-Alzheimer’s agents by targeting acetylcholinesterase and butyrylcholinesterase

    Article • In Silico Pharmacology, April 2026, Springer Science + Business Media

    Mohnad Abdalla

  5. Molecular docking and dynamics of some thiazolidine derivatives using the SARS-CoV-2 main protease as target protein

    Article • Journal of Applied Biological Chemistry, April 2026, Korean Society for Applied Biological Chemistry

    Mohnad Abdalla

  6. Sub-acute toxicity studies and dynamics-based molecular insights on the in vivo antimalarial activity of Ilex umbellulata (Wall.) Loes bark in Plasmodium berghei-infected mice

    Article • Journal of Ethnopharmacology, March 2026, Elsevier

    Mohnad Abdalla

  7. Discovery of novel pyridazinone derivatives as EGFRWT/ EGFRT790M kinase inhibitors; design, synthesis, antitumor evaluation, and molecular dynamic simulations

    Article • Bioorganic Chemistry, March 2026, Elsevier

    Mohnad Abdalla, Dr Wafa Ali Eltayb

  8. Computational approach by molecular docking and molecular dynamics of compounds from two Congolese medicinal plants as potent antisickling agents

    Article • Pharmacological Research - Natural Products, March 2026, Elsevier

    Mohnad Abdalla, Dr Wafa Ali Eltayb

  9. In Silico and In Vitro Analysis of Ganoderic Acid A Binding to Human Monocarboxylate Transporters 1 and 4

    Article • Proteins Structure Function and Bioinformatics, February 2026, Wiley

    Mohnad Abdalla

  10. Anti-HCV NS2-3 potential of selected plant bioactive compounds revealed by docking, simulation and DFT

    Article • Scientific Reports, February 2026, Springer Science + Business Media

    Mohnad Abdalla

  11. Applications of Marine Nanoscience and Nanotechnology

    Article • January 2026, Springer Science + Business Media

    Mohnad Abdalla

  12. In-silico investigations of bioactive compounds from ginger against Lassa fever virus nucleoprotein

    Article • Scientific Reports, December 2025, Springer Science + Business Media

    Mohnad Abdalla

  13. In Silico design and evaluation of novel anti-tubercular agents as Inha inhibitors through a virtual screening approach

    Article • Discover Chemistry, December 2025, Springer Science + Business Media

    Mohnad Abdalla

  14. In silico evaluation of the anti Helicobacter pylori activity of selected bioactive compounds from Aloe vera

    Article • Scientific Reports, November 2025, Springer Science + Business Media

    Mohnad Abdalla, Dr Wafa Ali Eltayb

  15. Low expression of MKRN1 promotes leukemia cell proliferation

    Article • European Journal of Medical Research, November 2025, Springer Science + Business Media

    Mohnad Abdalla

  16. Therapeutic potential of Moringa oleifera phytochemicals as modulators of cathepsin B for Alzheimer’s disease management: insights from molecular docking and dynamics simulations

    Article • Future Journal of Pharmaceutical Sciences, October 2025, Springer Science + Business Media

    Mohnad Abdalla

  17. Molecular Docking and Dynamics of 2,5-Pyrrolidinedione Analogue Using the SARS-CoV-2 Main Protease as Target Protein

    Article • Infection Epidemiology and Microbiology, October 2025, National Academy of Sciences of Tajikistan

    Mohnad Abdalla, Dr Wafa Ali Eltayb

  18. In-silico screening of small compounds against Lassa fever haemorrhagic virus nucleoprotein

    Article • Scientific Reports, August 2025, Springer Science + Business Media

    Mohnad Abdalla

  19. In-silico design and evaluation of quinoline-dione derivatives as Mycobacterium tuberculosis DprE1 inhibitors

    Article • Discover Molecules, August 2025, Springer Science + Business Media

    Mohnad Abdalla

  20. Discovery of novel thiazolopyrimidine derivatives targeting topoisomerase II: Design, synthesis, antiproliferative evaluation, molecular docking and apoptosis inducing activity

    Article • Bioorganic Chemistry, August 2025, Elsevier

    Mohnad Abdalla

  21. Investigation of the antimalarial efficacy of Ilex umbellulata (Wall.) Loes. bark against Plasmodium falciparum using in-vitro whole-cell assays, GC-MS, LC-ToF-MS, and multi-step computational studies

    Article • Journal of Ethnopharmacology, August 2025, Elsevier

    Mohnad Abdalla

  22. In-vitro and in-silico exploration of glycogen phosphorylase inhibition by Aloe sinkatana anthraquinones

    Article • Journal of Biomolecular Structure and Dynamics, July 2025, Taylor & Francis

    Mohnad Abdalla

  23. Identification of natural product inhibitors as potential drug candidates for treating Alzheimer's disease: molecular docking, molecular dynamics simulations, MM/GBSA and pharmacokinetics

    Article • Network Modeling Analysis in Health Informatics and Bioinformatics, June 2025, Springer Science + Business Media

    Mohnad Abdalla

  24. Clinical characteristics and genetic mutation analysis in 18 pediatric patients with Shwachman-Diamond syndrome

    Article • Frontiers in Genetics, June 2025, Frontiers

    Mohnad Abdalla

  25. KIFC1 inhibition: Exploring the potential of propolis-derived small molecules for targeting cancer progression through in silico analysis

    Article • PLOS One, June 2025, PLOS

    Mohnad Abdalla

  26. In silico analysis to explore the therapeutic potential of propolis-derived small molecules as matriptase inhibitors to suppress breast cancer growth and metastasis

    Article • PLOS One, May 2025, PLOS

    Mohnad Abdalla

  27. In-silico design of 3-Methyl-3H-naphtho[1,2,3-de]quinoline-2,7-dione Inhibitors against Tuberculosis via Docking and Dynamics Simulation Techniques, and Pharmacokinetic Evaluation

    Article • ASPET Discovery, May 2025, Elsevier

    Mohnad Abdalla

  28. Revealing the Therapeutic Potential of Pituranthos scoparius: Phytochemical Composition, Biological Activities, and Abiotic Stress Resilience Through In Vitro and In Silico Analyses from the Algerian Sahara

    Article • Chemistry & Biodiversity, April 2025, Wiley

    Mohnad Abdalla

  29. Integrated Experimental and Computational Study of Imidazopyridine Derivatives: Synthesis, DFT, Molecular Docking and Dynamic Simulations

    Article • Applied Organometallic Chemistry, April 2025, Wiley

    Mohnad Abdalla

  30. Insight Study For Repurposing Of Certain Anti‐Inflammatory Drugs Based On Aspirin and Salicylic Acid Scaffolds For The Treatment of Cancer as CDKs Inhibitors: Cheminformatics and Anticancer Studies

    Article • ChemistrySelect, April 2025, Wiley

    Mohnad Abdalla

  31. Wild-Type TP53 Predicts Poor Prognosis in Lower-Grade Glioma via TP53-CXCL14-GATA3 Axis

    Article • Journal of Molecular Neuroscience, March 2025, Springer Science + Business Media

    Mohnad Abdalla

  32. In silico discovery of new ornithine decarboxylase inhibitor with potential for human African trypanosomiasis treatment

    Article • Discover Chemistry, March 2025, Springer Science + Business Media

    Mohnad Abdalla

  33. Mechanistic approach in remedy of diabetes through plant bioactive polyphenolic compounds: an insilico study for modern drug discovery

    Article • Journal of Proteins and Proteomics, February 2025, Springer Science + Business Media

    Mohnad Abdalla

  34. GATA3 and aging raise the susceptibility of metastasis to high-grade serous ovarian carcinoma

    Article • Advanced Pharmaceutical Bulletin, February 2025, MaadRayan Publishing Company

    Mohnad Abdalla

  35. Allosteric activation of AMPK ADaM’s site by structural analogs of Epigallocatechin and Galegine: computational molecular modeling investigation

    Article • In Silico Pharmacology, January 2025, Springer Science + Business Media

    Mohnad Abdalla

  36. Boosting the catalytic efficiency of UGT51 for efficient production of rare ginsenoside Rh2

    Article • Folia Microbiologica, January 2025, Springer Science + Business Media

    Mohnad Abdalla, Professor Mohamed Fawzy Ramadan Hassanien

  37. Synthesis, characterization, and biological activity of silver nanofibers essential oils of prunus dulcis

    Article • Egyptian Pharmaceutical Journal, January 2025, Egypts Presidential Specialized Council for Education and Scientific Research

    Mohnad Abdalla

  38. Computational design, pharmacokinetics, molecular docking and molecular dynamic simulation of novel anti-tubercular inhibitors

    Article • In Silico Research in Biomedicine, January 2025, Elsevier

    Mohnad Abdalla

  39. Uncovering Potential Novel Antidiabetic Compounds from African Traditional Medicinal Plants: A Computer-Aided Study

    Article • Avicenna Journal of Medical Biochemistry, December 2024, MaadRayan Publishing Company

    Mohnad Abdalla

  40. MiR-34a regulates renal circadian rhythms during cisplatin-induced nephrotoxicity

    Article • Human Cell, December 2024, Springer Science + Business Media

    Mohnad Abdalla

  41. Molecular dynamics-based computational investigations on the influence of tumor suppressor p53 binding protein against other proteins/peptides

    Article • Scientific Reports, December 2024, Springer Science + Business Media

    Mohnad Abdalla

  42. Synthesis, characterization, and biological activity of silver nanofibers essential oils of prunus dulcis

    Article • Egyptian Pharmaceutical Journal, November 2024, Egypts Presidential Specialized Council for Education and Scientific Research

    Mohnad Abdalla

  43. Synthesis, characterization, antioxidant activity, docking and simulation of potential anticancer agents of azo dye for pyridyl and its palladium(II) complex

    Article • Bulletin of the Chemical Society of Ethiopia, November 2024, African Journals Online (AJOL)

    Mohnad Abdalla, Dr Wafa Ali Eltayb

  44. In-silico assessment of bioactive compounds from chewing stick (Salvadora persica) against N-acetylneuraminate lyase (5ZKA) of Fusobacterium nucleatum involved in salicyclic acid metabolism

    Article • Journal of Molecular Structure, November 2024, Elsevier

    Mohnad Abdalla

  45. Interactions between microbiota and uterine corpus endometrial cancer: A bioinformatic investigation of potential immunotherapy

    Article • PLOS One, October 2024, PLOS

    Mohnad Abdalla

  46. Cheminformatic evaluation of the multi-protein binding potential of some diselenide derivatives: A plausible drug discovery approach for leishmaniasis

    Article • Discover Chemistry, October 2024, Springer Science + Business Media

    Mohnad Abdalla

  47. Structure-based discovery of F. religiosa phytochemicals as potential inhibitors against Monkeypox (mpox) viral protein

    Article • Journal of Biosafety and Biosecurity, September 2024, Elsevier

    Mohnad Abdalla

  48. Synthesis, characterization, DFT, ADMET, MD analysis and molecular docking of C-3 functionalized imidazo[1,2-a]pyridine motifs

    Article • Journal of Molecular Structure, September 2024, Elsevier

    Mohnad Abdalla

  49. Synthesis, Characterization, Antibacterial, and Molecular Docking and Dynamics Studies of Novel 2-thioxoimidazolidin-4-one Analogue

    Article • Chemistry Africa, August 2024, Springer Science + Business Media

    Mohnad Abdalla

  50. Potential inhibitors of VEGFR1, VEGFR2, and VEGFR3 developed through Deep Learning for the treatment of Cervical Cancer

    Article • Scientific Reports, June 2024, Springer Science + Business Media

    Mohnad Abdalla

  51. Green synthesis of bio-mediated silver nanoparticles from Persea americana peels extract and evaluation of their biological activities: In vitro and in silico insights

    Article • Journal of Saudi Chemical Society, May 2024, Springer Science + Business Media

    Mohnad Abdalla

  52. Ganoderic acid A targets IL-1R1 and disrupts IL-1β binding in human cancer cells

    Article • Journal of Molecular Structure, April 2024, Elsevier

    Mohnad Abdalla

  53. Multitarget strategy of GATA3 and high-grade serous ovarian carcinoma: Where are we now?

    Article • Thrombosis Research, April 2024, Elsevier

    Mohnad Abdalla

  54. Real-world evidence: Risdiplam in a patient with spinal muscular atrophy type I with a novel splicing mutation and one SMN2 copy

    Article • Human Molecular Genetics, March 2024, Oxford University Press (OUP)

    Mohnad Abdalla

  55. Evaluation of chalcones as new glycogen phosphorylase inhibitors – an in-vitro and in-silico approach

    Article • Natural Product Research, March 2024, Taylor & Francis

    Mohnad Abdalla

  56. In-silico investigations of novel tacrine derivatives potency against Alzheimer's disease

    Article • Scientific African, March 2024, Elsevier

    Mohnad Abdalla

  57. Molecular dynamic analyses of the interaction of SARS-CoV-1 or 2 variants with various angiotensin-converting enzyme-2 species

    Article • Journal of Biomolecular Structure and Dynamics, February 2024, Taylor & Francis

    Mohnad Abdalla, Dr Wafa Ali Eltayb

  58. PDL-1 and insulin resistance in obesity: a possible pathway for macrovascular disease

    Article • Human Cell, January 2024, Springer Science + Business Media

    Mohnad Abdalla

  59. Inhibition of respiratory syncytial virus by Daclatasvir and its derivatives: synthesis of computational derivatives as a new drug development

    Article • Journal of Biomolecular Structure and Dynamics, January 2024, Taylor & Francis

    Mohnad Abdalla

  60. Explainable artificial intelligence-assisted virtual screening and bioinformatics approaches for effective bioactivity prediction of phenolic cyclooxygenase-2 (COX-2) inhibitors using PubChem molecular fingerprints

    Article • Molecular Diversity, January 2024, Springer Science + Business Media

    Mohnad Abdalla

  61. Dual inhibitory potential of ganoderic acid A on GLUT1/3: computational and in vitro insights into targeting glucose metabolism in human lung cancer

    Article • RSC Advances, January 2024, Royal Society of Chemistry

    Mr. Mohammed Sharif Swallah, Mohnad Abdalla

  62. Cholinesterase Inhibitory Activity of Paeoniflorin: Molecular Dynamics Simulation, and In Vitro Mechanistic Investigation

    Article • Biochemistry Research International, January 2024, Wiley

    Mohnad Abdalla

  63. Potential honey bee (Apis mellifera) allergens associated with IgE-mediated allergy- An In-silico study

    Article • Cellular and Molecular Biology, December 2023, CMB Association

    Mohnad Abdalla

  64. Fullerene (C60) Supplementation Stimulated Anammox Granules at Low Doses and Inhibition Occurred at High Doses: Phenomenon and Mechanism

    Article • ACS ES&T Engineering, December 2023, American Chemical Society (ACS)

    Mohnad Abdalla, Dr. Sherif Ahmed Ismail

  65. Development and optimization of film forming non-pressurized liquid bandage for wound healing by Box-Behnken statistical design

    Article • Saudi Pharmaceutical Journal, December 2023, Elsevier

    Mohnad Abdalla

  66. Cheminformatics-based discovery of new organoselenium compounds with potential for the treatment of cutaneous and visceral leishmaniasis

    Article • Journal of Biomolecular Structure and Dynamics, November 2023, Taylor & Francis

    Mohnad Abdalla

  67. Identification of novel dual acting ligands targeting the adenosine A2A and serotonin 5-HT1A receptors

    Article • Journal of Biomolecular Structure and Dynamics, October 2023, Taylor & Francis

    Mohnad Abdalla

  68. Relationship between gut microbiota dysbiosis and immune indicator in children with sepsis

    Article • BMC Pediatrics, October 2023, Springer Science + Business Media

    Mohnad Abdalla

  69. Preparation of LSPR enhanced Z-scheme Pd/WO3@SnO2 for photocatalytic decomposition of organic compounds under simulated sunlight

    Article • Journal of Environmental Chemical Engineering, October 2023, Elsevier

    Mohnad Abdalla

  70. Promising Experimental Anti-SARS-CoV-2 Agent “SLL-0197800”: The Prospective Universal Inhibitory Properties against the Coming Versions of the Coronavirus

    Article • ACS Omega, September 2023, American Chemical Society (ACS)

    Mohnad Abdalla

  71. Combination of Synonymous and Missense Mutations in JAK3 Gene Contributes to Severe Combined Immunodeficiency in One Child

    Article • Human Mutation, September 2023, Hindawi Publishing Corporation

    Mohnad Abdalla

  72. Metformin as a promising target for DPP4 expression: computational modeling and experimental validation

    Article • Medical Oncology, August 2023, Springer Science + Business Media

    Mohnad Abdalla

  73. CTLA-4 and ovarian cancer residual tumors: the dark side of debulking surgery

    Article • Human Cell, August 2023, Springer Science + Business Media

    Mohnad Abdalla

  74. In-silico screening of Acacia pennata and Bridelia retusa reveals pinocembrin-7-O-β-D-glucopyranoside as a promising β-lactamase inhibitor to combat antibiotic resistance

    Article • Journal of Biomolecular Structure and Dynamics, August 2023, Taylor & Francis

    Mohnad Abdalla

  75. Potential Effect of Baobab’s Polyphenols as Antihyperlipidemic Agents: In Silico Study

    Article • Molecules, August 2023, MDPI AG

    Mohnad Abdalla

  76. Acute necrotizing encephalopathy in children with COVID-19: a retrospective study of 12 cases

    Article • Frontiers in Neurology, August 2023, Frontiers

    Mohnad Abdalla

  77. Immune Checkpoint Inhibitors: Recent Clinical Advances and Future Prospects

    Article • Current Medicinal Chemistry, August 2023, Bentham Science Publishers

    Mohnad Abdalla

  78. Molecular interactions, binding stability, and synergistic inhibition on Acetylcholinesterase activity of Safranin O in combination with Quercetin and Gallic acid: In vitro and in silico study

    Article • Journal of Molecular Structure, August 2023, Elsevier

    Mohnad Abdalla, Dr Wafa Ali Eltayb

  79. Molecular modeling study of micro and nanocurcumin with in vitro and in vivo antibacterial validation

    Article • Scientific Reports, July 2023, Springer Science + Business Media

    Mohnad Abdalla, Dr Wafa Ali Eltayb

  80. Interplay between LPL and GPIHBP1 in COVID-19 patients: a possible mechanism for post-recovery cardiomyopathy

    Article • Human Cell, July 2023, Springer Science + Business Media

    Mohnad Abdalla

  81. Microplastics in canned, salt-dried, and instant sea cucumbers sold for human consumption

    Article • Marine Pollution Bulletin, July 2023, Elsevier

    Mohnad Abdalla

  82. Molecular dynamic and bioinformatic studies of metformin-induced ACE2 phosphorylation in the presence of different SARS-CoV-2 S protein mutations

    Article • Saudi Journal of Biological Sciences, July 2023, Elsevier

    Mohnad Abdalla

  83. Constituents of Stachys plants as potential dual inhibitors of AChE and NMDAR for the treatment of Alzheimer’s disease: a molecular docking and dynamic simulation study

    Article • Journal of Biomolecular Structure and Dynamics, June 2023, Taylor & Francis

    Mohnad Abdalla

  84. Syphilis mimetic nanoparticles for cuproptosis-based synergistic cancer therapy via reprogramming copper metabolism

    Article • International Journal of Pharmaceutics, June 2023, Elsevier

    Mohnad Abdalla

  85. Dual synergistic inhibition of COX and LOX by potential chemicals from Indian daily spices investigated through detailed computational studies

    Article • Scientific Reports, May 2023, Springer Science + Business Media

    Mohnad Abdalla, Dr Wafa Ali Eltayb

  86. Synthesis, characterization, antimicrobial studies, and molecular docking studies of transition metal complexes formed from a benzothiazole-based azo ligand

    Article • Bulletin of the Chemical Society of Ethiopia, May 2023, African Journals Online (AJOL)

    Mohnad Abdalla

  87. Synthesis, characterization, antimicrobial studies, and molecular docking studies of transition metal complexes formed from a benzothiazole-based azo ligand

    Article • Bulletin of the Chemical Society of Ethiopia, May 2023, African Journals Online (AJOL)

    Mohnad Abdalla

  88. Exploring particulate methane monooxygenase (pMMO) proteins using experimentation and computational molecular docking

    Article • Journal of King Saud University - Science, May 2023, Elsevier

    Mohnad Abdalla, Dr Wafa Ali Eltayb

  89. N ‐Aroyl‐ N′ ‐(1‐Naphthyl)‐ N′′ ‐aryl guanidines as a New Entry to Urease Inhibitors: Synthesis, Kinetic Mechanism, Molecular Docking and MD Simulation Studies

    Article • ChemistrySelect, April 2023, Wiley

    Mohnad Abdalla

  90. Revisiting macrophages in ovarian cancer microenvironment: development, function and interaction

    Article • Medical Oncology, April 2023, Springer Science + Business Media

    Mohnad Abdalla

  91. Structure-Based Virtual Screening, Molecular Docking, Molecular Dynamics Simulation of EGFR for the Clinical Treatment of Glioblastoma

    Article • Applied Biochemistry and Biotechnology, March 2023, Springer Science + Business Media

    Mohnad Abdalla

  92. Threat of respiratory syncytial virus infection knocking the door: a proposed potential drug candidate through molecular dynamics simulations, a future alternative

    Article • Journal of Molecular Modeling, March 2023, Springer Science + Business Media

    Mohnad Abdalla

  93. Study on Molecular Anti-tumor Mechanism of 2-Thiohydantoin Derivative based on Molecular Docking and Bioinformatic Analyses

    Article • Current Topics in Medicinal Chemistry, March 2023, Bentham Science Publishers

    Mohnad Abdalla, Dr Wafa Ali Eltayb

  94. GC-MS Based Metabolite Profiling, and Anti-Inflammatory Activity of Aqueous Extract of Myrica esculenta through In Vitro and In Silico Approach

    Article • March 2023, MDPI AG

    Mohnad Abdalla, Dr Wafa Ali Eltayb

  95. Distinct roles of carbohydrate-binding modules in multidomain β-1,3–1,4-glucanase on polysaccharide degradation

    Article • Applied Microbiology and Biotechnology, February 2023, Springer Science + Business Media

    Mohnad Abdalla

  96. Remodeling articular immune homeostasis with an efferocytosis-informed nanoimitator mitigates rheumatoid arthritis in mice

    Article • Nature Communications, February 2023, Springer Science + Business Media

    Mohnad Abdalla

  97. Multi-target molecular dynamic simulations reveal glutathione-S-transferase as the most favorable drug target of knipholone in Plasmodium falciparum

    Article • Journal of Biomolecular Structure and Dynamics, February 2023, Taylor & Francis

    Mohnad Abdalla

  98. Novel Investigational Anti-SARS-CoV-2 Agent Ensitrelvir “S-217622”: A Very Promising Potential Universal Broad-Spectrum Antiviral at the Therapeutic Frontline of Coronavirus Species

    Article • ACS Omega, January 2023, American Chemical Society (ACS)

    Mohnad Abdalla, Dr Wafa Ali Eltayb

  99. Above the Invasive and Ornamental Attributes of the Traveler’s Palm: An In Vitro and In Silico Insight into the Anti-Oxidant, Anti-Enzymatic, Cytotoxic and Phytochemical Characterization of Ravenala madagascariensis

    Article • Antioxidants, January 2023, MDPI AG

    Mohnad Abdalla

  100. Novel slow-binding reversible acetylcholinesterase inhibitors based on uracil moieties for possible treatment of myasthenia gravis and protection from organophosphate poisoning

    Article • European Journal of Medicinal Chemistry, January 2023, Elsevier

    Mohnad Abdalla, Dr Wafa Ali Eltayb

  101. A bioinformatic analysis of the role of TP53 status on the infiltration of CD8+ T cells into the tumor microenvironment

    Article • Brazilian Journal of Medical and Biological Research, January 2023, FapUNIFESP (SciELO)

    Mohnad Abdalla

  102. Evaluation of a series of nucleoside analogs as effective anticoronaviral-2 drugs against the Omicron-B.1.1.529/BA.2 subvariant: A repurposing research study

    Article • Medicinal Chemistry Research, December 2022, Springer Science + Business Media

    Mohnad Abdalla

  103. Trojan Horse Nanocapsule Enabled in Situ Modulation of the Phenotypic Conversion of Th17 Cells to Treg Cells for the Treatment of Multiple Sclerosis in Mice

    Article • Advanced Materials, December 2022, Wiley

    Mohnad Abdalla

  104. A Series of Adenosine Analogs as the First Efficacious Anti‐SARS‐CoV‐2 Drugs against the B.1.1.529.4 Lineage: A Preclinical Repurposing Research Study

    Article • ChemistrySelect, December 2022, Wiley

    Mohnad Abdalla

  105. Antibacterial and antibiofilm activity of mannose-modified chitosan/PMLA nanoparticles against multidrug-resistant Helicobacter pylori

    Article • International Journal of Biological Macromolecules, December 2022, Elsevier

    Mohnad Abdalla, Dr Wafa Ali Eltayb

  106. Inhibition of the predicted allosteric site of the SARS-CoV-2 main protease through flavonoids

    Article • Journal of Biomolecular Structure and Dynamics, November 2022, Taylor & Francis

    Mohnad Abdalla, Dr Syed Naeem Badshah Professor/Chairman

  107. Novel Copper Oxide Bio-Nanocrystals to Target Outer Membrane Lectin of Vancomycin-Resistant Enterococcus faecium (VREfm): In Silico, Bioavailability, Antimicrobial, and Anticancer Potential

    Article • Molecules, November 2022, MDPI AG

    Mohnad Abdalla, Mahmoud Kandeel

  108. Insight into the Hantaan virus RNA-dependent RNA polymerase inhibition using in-silico approaches

    Article • Molecular Diversity, November 2022, Springer Science + Business Media

    Mohnad Abdalla, Dr Syed Naeem Badshah Professor/Chairman

  109. A Comprehensive Study of N-Butyl-1H-Benzimidazole

    Article • Molecules, November 2022, MDPI AG

    Mohnad Abdalla

  110. In-silico studies of glutathione peroxidase4 activators as candidate for multiple sclerosis management

    Article • Journal of Saudi Chemical Society, November 2022, Elsevier

    Mohnad Abdalla

  111. Forodesine and Riboprine Exhibit Strong Anti-SARS-CoV-2 Repurposing Potential: In Silico and In Vitro Studies

    Article • ACS Bio & Med Chem Au, October 2022, American Chemical Society (ACS)

    Mohnad Abdalla

  112. GATA3 as an immunomodulator in obesity-related metabolic dysfunction associated with fatty liver disease, insulin resistance, and type 2 diabetes

    Article • Chemico-Biological Interactions, October 2022, Elsevier

    Mohnad Abdalla

  113. Hypertension is still a moving target in the context of COVID‐19 and post‐acute COVID‐19 syndrome

    Article • Journal of Medical Virology, September 2022, Wiley

    Mohnad Abdalla

  114. Stimulating the Fermentation Process of Industrial Food Waste via Nonionic Surfactant/Graphene Nanosheet Combined Supplementation

    Article • ACS ES&T Engineering, September 2022, American Chemical Society (ACS)

    Mohnad Abdalla, Dr. Sherif Ahmed Ismail

  115. Cardiovascular complications in the post-acute COVID-19 syndrome: A novel perspective down the road

    Article • Travel Medicine and Infectious Disease, September 2022, Elsevier

    Mohnad Abdalla

  116. Dual Computational and Biological Assessment of Some Promising Nucleoside Analogs against the COVID-19-Omicron Variant

    Article • Computational Biology and Chemistry, September 2022, Elsevier

    Mohnad Abdalla

  117. Multifunctional nanoparticles based on marine polysaccharides for apremilast delivery to inflammatory macrophages: Preparation, targeting ability, and uptake mechanism

    Article • International Journal of Biological Macromolecules, September 2022, Elsevier

    Mohnad Abdalla

  118. Identification and Inhibition of the Druggable Allosteric Site of SARS-CoV-2 NSP10/NSP16 Methyltransferase through Computational Approaches

    Article • Molecules, August 2022, MDPI AG

    Mohnad Abdalla, Dr Syed Naeem Badshah Professor/Chairman

  119. MD Simulation Studies for Selective Phytochemicals as Potential Inhibitors against Major Biological Targets of Diabetic Nephropathy

    Article • Molecules, August 2022, MDPI AG

    Dr Mohammed Kuddus, Mohnad Abdalla, Dr Wafa Ali Eltayb, Fahmida Khatoon

  120. Intracavity generation of glioma stem cell–specific CAR macrophages primes locoregional immunity for postoperative glioblastoma therapy

    Article • Science Translational Medicine, August 2022, American Association for the Advancement of Science

    Mohnad Abdalla

  121. In Silico Study and Excito-Repellent Activity of Vitex negundo L. Essential Oil against Anopheles gambiae

    Article • Applied Sciences, July 2022, MDPI AG

    Dr Bamidele Joseph Okoli, Mohnad Abdalla, Dr Wafa Ali Eltayb

  122. Rhamnolipid-Coated Iron Oxide Nanoparticles as a Novel Multitarget Candidate against Major Foodborne E. coli Serotypes and Methicillin-Resistant S. aureus

    Article • Microbiology Spectrum, July 2022, ASM Journals

    Mohnad Abdalla

  123. Epigenetic drug (XL019) JAK2 inhibitor increases mitochondrial function in brown adipocytes by upregulating mitochondrial uncoupling protein 1 (UCP1), screening of epigenetic drug libraries, cell viability, and in-silico studies

    Article • Journal of Saudi Chemical Society, July 2022, Elsevier

    Mohnad Abdalla

  124. Computational studies on potential new anti-Covid-19 agents with a multi-target mode of action

    Article • Journal of King Saud University - Science, July 2022, Elsevier

    Mohnad Abdalla

  125. Comprehensive structural and functional characterization of a seed γ-thionin as a potent bioactive molecule against fungal pathogens and insect pests

    Article • Current Medicinal Chemistry, June 2022, Bentham Science Publishers

    Mohnad Abdalla, Dr Wafa Ali Eltayb

  126. Berberine chloride (dual topoisomerase I and II inhibitor) modulate mitochondrial uncoupling protein (UCP1) in molecular docking and dynamic with in-vitro cytotoxic and mitochondrial ATP production

    Article • Journal of Biomolecular Structure and Dynamics, May 2022, Taylor & Francis

    Mohnad Abdalla

  127. Sarcorucinine-D Inhibits Cholinesterases and Calcium Channels: Molecular Dynamics Simulation and In Vitro Mechanistic Investigations

    Article • Molecules, May 2022, MDPI AG

    Miss Maria Saeed, Mohnad Abdalla

  128. Chalcone Scaffolds Exhibiting Acetylcholinesterase Enzyme Inhibition: Mechanistic and Computational Investigations

    Article • Molecules, May 2022, MDPI AG

    Mohnad Abdalla

  129. Bioinspired nano-painting on orthopedic implants orchestrates periprosthetic anti-infection and osseointegration in a rat model of arthroplasty

    Article • Chemical Engineering Journal, May 2022, Elsevier

    Mohnad Abdalla

  130. In-silico investigation of phenolic compounds from leaves of Phillyrea angustifolia L. as a potential inhibitor against the SARS-CoV-2 main protease (Mpro PDB ID:5R83) using a virtual screening method

    Article • Journal of Saudi Chemical Society, May 2022, Elsevier

    Mohnad Abdalla

  131. Glycyrrhizin (Glycyrrhizic Acid) HMGB1 (high mobility group box 1) inhibitor upregulate mitochondrial function in adipocyte, cell viability and in-silico study

    Article • Journal of Saudi Chemical Society, May 2022, Elsevier

    Mohnad Abdalla

  132. Structure-Based Virtual Screening, Molecular Docking, Molecular Dynamics Simulation and Pharmacokinetic modelling of Cyclooxygenase-2 (COX-2) inhibitor for the clinical treatment of Colorectal Cancer

    Article • Molecular Simulation, April 2022, Taylor & Francis

    Mohnad Abdalla

  133. Anticancer, antioxidant activities and molecular docking study of thiazolidine-4-one and thiadiazol derivatives

    Article • Journal of Biomolecular Structure and Dynamics, April 2022, Taylor & Francis

    Mohnad Abdalla

  134. The role of GATA3 in the metastasis of triple-negative breast cancer and high-grade serous ovarian cancer

    Article • Human Cell, April 2022, Springer Science + Business Media

    Mohnad Abdalla

  135. Synthesis, crystal structure, hirshfeld surface analysis, molecular docking and molecular dynamics studies of novel olanzapinium 2,5-dihydroxybenzoate as potential and active antipsychotic compound

    Article • Journal of Experimental Nanoscience, April 2022, Taylor & Francis

    Mohnad Abdalla

  136. Trigonella foenum-graecum Methanolic Extract on Isolated Smooth Muscles and Acetylcholinesterase Enzyme: An In Vitro and Mechanistic In Silico Investigation

    Article • BioMed Research International, April 2022, Hindawi Publishing Corporation

    Mohnad Abdalla

  137. Structure-Based Virtual Screening, Molecular Docking, and Molecular Dynamics Simulation of VEGF inhibitors for the clinical treatment of Ovarian Cancer

    Article • Journal of Molecular Modeling, March 2022, Springer Science + Business Media

    Mohnad Abdalla

  138. Computational Investigations for Identification of Bioactive Molecules from Baccaurea ramiflora and Bergenia ciliata as Inhibitors of SARS-CoV-2 Mpro

    Article • Polycyclic Aromatic Compounds, March 2022, Taylor & Francis

    Mohnad Abdalla

  139. Inhaled mRNA Nanoformulation with Biogenic Ribosomal Protein Reverses Established Pulmonary Fibrosis in a Bleomycin‐Induced Murine Model

    Article • Advanced Materials, March 2022, Wiley

    Mohnad Abdalla

  140. Spectroscopic, Solvation Effects and MD Simulation of an Adamantane-Carbohydrazide Derivative, a Potential Antiviral Agent

    Article • Polycyclic Aromatic Compounds, February 2022, Taylor & Francis

    Mohnad Abdalla, Professor Ali A El-Emam

  141. Corrigendum: Effects of Zinc Oxide Nanoparticles Synthesized Using Aspergillus niger on Carbapenem-Resistant Klebsiella pneumonia In Vitro and In Vivo

    Article • Frontiers in Cellular and Infection Microbiology, February 2022, Frontiers

    Mohnad Abdalla

  142. Molecular dynamic study of SARS-CoV-2 with various S protein mutations and their effect on thermodynamic properties

    Article • Computers in Biology and Medicine, February 2022, Elsevier

    Mohnad Abdalla, Dr Wafa Ali Eltayb

  143. Correction to: Arabidopsis NLP7 improves nitrogen use efficiency and yield in cotton

    Article • Journal of Cotton Research, January 2022, Springer Science + Business Media

    Mohnad Abdalla

  144. Arabidopsis NLP7 improves nitrogen use efficiency and yield in cotton

    Article • Journal of Cotton Research, January 2022, Springer Science + Business Media

    Mohnad Abdalla

  145. Molecular docking and dynamic simulations of Cefixime, Etoposide and Nebrodenside A against the pathogenic proteins of SARS-CoV-2

    Article • Journal of Molecular Structure, January 2022, Elsevier

    Mohnad Abdalla

  146. Preparation, urease inhibition mechanisms, and anti-Helicobacter pylori activities of hesperetin-7-rhamnoglucoside

    Article • Current Research in Microbial Sciences, January 2022, Elsevier

    Mohnad Abdalla

  147. Novel Slow-Binding Reversible Acetylcholinesterase Inhibitors Based on Uracil Moieties for Possible Treatment of Myasthenia Gravis and Protection from Organophosphate Poisoning

    Article • SSRN Electronic Journal, January 2022, Elsevier

    Mohnad Abdalla

  148. Computational Study of SARS-CoV-2 RNA Dependent RNA Polymerase Allosteric Site Inhibition

    Article • Molecules, December 2021, MDPI AG

    Mohnad Abdalla

  149. Novel Schiff Bases Ligands and Their Complexes: Thermal Analysis, Antibacterial Activity, and Molecular Docking

    Article • Egyptian Journal of Chemistry, December 2021, Egypts Presidential Specialized Council for Education and Scientific Research

    Mohnad Abdalla

  150. In silico identification and study of potential anti-mosquito juvenile hormone binding protein (MJHBP) compounds as candidates for dengue virus - Vector insecticides

    Article • Biochemistry and Biophysics Reports, December 2021, Elsevier

    Mohnad Abdalla

  151. In silico studies on phytochemicals to combat the emerging COVID-19 infection

    Article • Journal of Saudi Chemical Society, December 2021, Elsevier

    Mohnad Abdalla, Dr Wafa Ali Eltayb

  152. Phenolic profile, antioxidant and enzyme inhibition properties of seed methanolic extract of seven new Sunflower lines: From fields to industrial applications

    Article • Process Biochemistry, December 2021, Elsevier

    Mohnad Abdalla

  153. Repurposing benzimidazole and benzothiazole derivatives as potential inhibitors of SARS-CoV-2: DFT, QSAR, molecular docking, molecular dynamics simulation, and in-silico pharmacokinetic and toxicity studies

    Article • Journal of King Saud University - Science, December 2021, Elsevier

    Mohnad Abdalla

  154. What are the challenges faced by COVID-19 vaccines?

    Article • Expert Review of Vaccines, November 2021, Taylor & Francis

    Mohnad Abdalla

  155. Effects of Zinc Oxide Nanoparticles Synthesized Using Aspergillus niger on Carbapenem-Resistant Klebsiella pneumonia In Vitro and In Vivo

    Article • Frontiers in Cellular and Infection Microbiology, November 2021, Frontiers

    Mohnad Abdalla

  156. Long-Term Impact of Transhumance Pastoralism and Associated Disturbances in High-Altitude Forests of Indian Western Himalaya

    Article • Sustainability, November 2021, MDPI AG

    Mohnad Abdalla

  157. Species Distribution Pattern and Their Contribution in Plant Community Assembly in Response to Ecological Gradients of the Ecotonal Zone in the Himalayan Region

    Article • Plants, November 2021, MDPI AG

    Mohnad Abdalla

  158. Botrytis cinerea alcohol dehydrogenase mediates fungal development, environmental adaptation and pathogenicity

    Article • Journal of Biomolecular Structure and Dynamics, September 2021, Taylor & Francis

    Mohnad Abdalla, Dr Wafa Ali Eltayb

  159. Design of lipid-based nanocarrier for drug delivery has a double therapy for six common pathogens eradication

    Article • Colloids and Surfaces A Physicochemical and Engineering Aspects, September 2021, Elsevier

    Mohnad Abdalla

  160. Ebselen suitably interacts with the potential SARS-CoV-2 targets: an in-silico approach

    Article • Journal of Biomolecular Structure and Dynamics, August 2021, Taylor & Francis

    Mohnad Abdalla

  161. In the face of the future, what do we learn from COVID-19?

    Article • Human Vaccines & Immunotherapeutics, August 2021, Taylor & Francis

    Mohnad Abdalla

  162. Plant Resources Utilization among Different Ethnic Groups of Ladakh in Trans-Himalayan Region

    Article • Biology, August 2021, MDPI AG

    Mohnad Abdalla

  163. GATA3 as a regulator for naughty cancer-associated fibroblasts in the microenvironment of high-grade serous ovarian cancer

    Article • Human Cell, August 2021, Springer Science + Business Media

    Mohnad Abdalla

  164. Species-specific and altitude-related variations in stomatal features ofBerberis lyciumRoyle and B. parkeriana C.K. Schneid

    Article • Botany Letters, July 2021, Taylor & Francis

    Mohnad Abdalla

  165. Co-delivery of hesperidin and clarithromycin in a nanostructured lipid carrier for the eradication of Helicobacter pylori in vitro

    Article • Bioorganic Chemistry, July 2021, Elsevier

    Mohnad Abdalla

  166. Future Directions of Fibrosis in Medicine

    Article • Digestive Diseases, June 2021, Karger Publishers

    Mohnad Abdalla

  167. Are the new SARS-CoV-2 variants resistant against the vaccine?

    Article • Human Vaccines & Immunotherapeutics, May 2021, Taylor & Francis

    Mohnad Abdalla

  168. Caffeic acid derivatives (CAFDs) as inhibitors of SARS-CoV-2: CAFDs-based functional foods as a potential alternative approach to combat COVID-19

    Article • Phytomedicine, May 2021, Elsevier

    Mohnad Abdalla

  169. Progress in research on the S protein as the target of COVID-19 vaccines

    Article • Expert Review of Vaccines, April 2021, Taylor & Francis

    Mohnad Abdalla

  170. Neuropilin-1 may be responsible for retinal findings in patients with COVID-19

    Article • Human Cell, April 2021, Springer Science + Business Media

    Mohnad Abdalla

  171. Analgesic and Anti-Inflammatory Potential of Essential Oil of Eucalyptus camaldulensis Leaf: In Vivo and in Silico Studies

    Article • Natural Product Communications, April 2021, SAGE Publications

    Mohnad Abdalla, Dr Javad Sharifi Rad

  172. Reply to “Comment on ‘In Situ Mannosylated Nanotrinity-Mediated Macrophage Remodeling Combats Candida Albicans Infection’”

    Article • ACS Nano, March 2021, American Chemical Society (ACS)

    Mohnad Abdalla

  173. Transplacental transmission of SARS-CoV-2 infection via NRP1

    Article • Travel Medicine and Infectious Disease, March 2021, Elsevier

    Mohnad Abdalla

  174. Ovarian cancer immunotherapy of NF-κB may have a dark side

    Article • Human Cell, January 2021, Springer Science + Business Media

    Mohnad Abdalla

  175. Emerging mutations in envelope protein of SARS-CoV-2 and their effect on thermodynamic properties

    Article • Informatics in Medicine Unlocked, January 2021, Elsevier

    Mohnad Abdalla

  176. SnapShot: TP53 status and macrophages infiltration in TCGA-analyzed tumors

    Article • International Immunopharmacology, September 2020, Elsevier

    Mohnad Abdalla

  177. Metformin and COVID‐19: A novel deal of an old drug

    Article • Journal of Medical Virology, June 2020, Wiley

    Mohnad Abdalla

  178. GATA3 and stemness of high-grade serous ovarian carcinoma: novel hope for the deadliest type of ovarian cancer

    Article • Human Cell, May 2020, Springer Science + Business Media

    Mohnad Abdalla

  179. In situ tuning proangiogenic factor-mediated immunotolerance synergizes the tumoricidal immunity via a hypoxia-triggerable liposomal bio-nanoreactor

    Article • Theranostics, January 2020, Ivyspring International Publisher

    Mohnad Abdalla

  180. Formononetin: Novel Deal for Androgenetic Alopecia

    Article • Archives of Medical Research, January 2020, Elsevier

    Mohnad Abdalla

  181. Alkaline hydrogen peroxide pretreatment of bamboo culm for improved enzymatic release of reducing sugars using recombinant cellulases

    Article • Cellulose, November 2019, Springer Science + Business Media

    Mohnad Abdalla

  182. Molecular cloning, expression, purification, and functional characterization of SP‐22 gene from Bombyx mori

    Article • Journal of Cellular Biochemistry, May 2019, Wiley

    Mohnad Abdalla, Dr Wafa Ali Eltayb

  183. Metformin: Ongoing Journey with Superdrug Revolution

    Article • Advanced Pharmaceutical Bulletin, February 2019, MaadRayan Publishing Company

    Mohnad Abdalla, Dr Wafa Ali Eltayb

  184. Rifabutin induced multinucleated hepatocytes in rats: an overview with future prospects

    Article • European Journal of Clinical Microbiology & Infectious Diseases, October 2018, Springer Science + Business Media

    Mohnad Abdalla

  185. Comparison of structures among Saccharomyces cerevisiae Grxs proteins

    Article • Genes and Environment, September 2018, Springer Science + Business Media

    Mohnad Abdalla, Dr Wafa Ali Eltayb

  186. Key Factors for Successful Protein Purification and Crystallization

    Article • Global Journal of Biotechnology and Biomaterial Science, August 2018, Peertechz.com

    Mohnad Abdalla

  187. Structure analysis of yeast glutaredoxin Grx6 protein produced in Escherichia coli

    Article • Genes and Environment, August 2018, Springer Science + Business Media

    Mohnad Abdalla, Dr Wafa Ali Eltayb

  188. Structural and Biochemical Insights into the Multiple Functions of Yeast Grx3

    Article • Journal of Molecular Biology, April 2018, Elsevier

    Mohnad Abdalla

  189. Identification of new pathogenicity related to the gene encoding hypothetical protein in the gray mold fungus (Botrytis cinerea)

    Article • Australian Journal of Crop Science, October 2017, Southern Cross Publishing

    Mohnad Abdalla, Dr Wafa Ali Eltayb

  190. Effect of Coriolus versicolor glucan on the stimulation of cytokine production in sarcoma-180-bearing mice

    Article • Biomedical Reports, October 2017, Spandidos Publications

    Mohnad Abdalla

  191. Number of Cysteine Interactions with the Activity in GRX Family

    Article • Journal of Proteomics & Bioinformatics, January 2017, OMICS Publishing Group

    Mohnad Abdalla, Dr Wafa Ali Eltayb

  192. Important Factors Influencing Protein Crystallization

    Article • September 2016, Peertechz.com

    Mohnad Abdalla, Dr Wafa Ali Eltayb

  193. Crystal structure of yeast monothiol glutaredoxin Grx6 in complex with a glutathione-coordinated [2Fe–2S] cluster

    Article • Acta Crystallographica Section F Structural Biology Communications, September 2016, International Union of Crystallography

    Mohnad Abdalla, Dr Wafa Ali Eltayb