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Journal of Biomolecular Structure & Dynamics|August 29, 2022
Computational investigation of peptidomimetics as potential inhibitors of SARS-CoV-2 spike proteinMayar Tarek Ibrahim, Peng TaoJournal of Chemical Information and Modeling|July 9, 2026
Transition Mechanism of the Human Dopamine Transporter via Molecular Dynamics SimulationsMayar Tarek Ibrahim, Pengyu RenComputational and Structural Biotechnology Journal|January 3, 2022
Dynamics of hydrogen bonds in the secondary structures of allosteric protein <i>Avena Sativa</i> phototropin 1Mayar Tarek Ibrahim, Francesco Trozzi, Peng TaoMolecules (Basel, Switzerland)|July 27, 2024
Quantum Mechanics Characterization of Non-Covalent Interaction in Nucleotide FragmentsMayar Tarek Ibrahim, Elizabeth Wait, Pengyu RenMolecular Diversity|September 1, 2022
Homology modeling of Forkhead box protein C2: identification of potential inhibitors using ligand and structure-based virtual screeningMayar Tarek Ibrahim, Jiyong Lee, Peng TaoInternational Journal of Molecular Sciences|May 27, 2023
Novel Allosteric Effectors Targeting Human Transcription Factor TEADMayar Tarek Ibrahim, Gennady M Verkhivker, Jyoti Misra, et al.Biophysical Journal|November 14, 2025
Insights into fibrinogen mechanics under cyclic high-strain loadingMayar Tarek Ibrahim, Sajjad Norouzi, Uma Paul, et al.Biorxiv : the Preprint Server for Biology|January 8, 2024
Microsecond Molecular Dynamics Simulations and Markov State Models of Mutation-Induced Allosteric Mechanisms for the Light-Oxygen-Voltage 2 Protein : Revealing Structural Basis of Signal Transmission Induced by Photoactivation of the Light Protein StateSian Xiao, Mayar Tarek Ibrahim, Gennady M Verkhivker, et al.Journal of Computational Chemistry|March 13, 2024
β-sheets mediate the conformational change and allosteric signal transmission between the AsLOV2 terminiSian Xiao, Mayar Tarek Ibrahim, Gennady M Verkhivker, et al.Journal of Controlled Release : Official Journal of the Controlled Release Society|June 25, 2021
Cancer immunotherapy from biology to nanomedicineSalma B Abdelbaky, Mayar Tarek Ibrahim, Hebatallah Samy, et al.Pageof 1