Tagyedeen H Shoaib

4PUBLICATIONS
18CO-AUTHORS
Deep learningBiomolecular modelling and designMolecular targetsCheminformatics and quantitative structure-activity relationships
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Publications (4)

|Dec 30, 2025
In Silico Lead Identification of Staphylococcus aureus LtaS Inhibitors: A High-Throughput Computational Pipeline Towards Prototype Development.

Abdulaziz H Al Khzem, Tagyedeen H Shoaib, Rua M Mukhtar

|Feb 26, 2025
Repurposing FDA-Approved Agents to Develop a Prototype Helicobacter pylori Shikimate Kinase (HPSK) Inhibitor: A Computational Approach Using Virtual Screening, MM-GBSA Calculations, MD Simulations, and DFT Analysis.

Abdulaziz H Al Khzem, Tagyedeen H Shoaib, Rua M Mukhtar

|Oct 27, 2023
Marine-Derived Compounds for CDK5 Inhibition in Cancer: Integrating Multi-Stage Virtual Screening, MM/GBSA Analysis and Molecular Dynamics Investigations.

Tagyedeen H Shoaib, Mohammed A Almogaddam, Yusra Saleh Andijani

|Sep 28, 2023
Molecular Docking and Molecular Dynamics Studies Reveal the Anticancer Potential of Medicinal-Plant-Derived Lignans as MDM2-P53 Interaction Inhibitors.

Tagyedeen H Shoaib, Nihal Abdelmoniem, Rua M Mukhtar

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Frequent Collaborators

2 joint publications

Shaimaa G A Mohamed

2 joint publications

Gamal A Mohamed

2 joint publications

Sabrin R M Ibrahim

2 joint publications

Abdulrahim A Alzain