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  1. The nucleoside adenosine inhibits intracellular microvascular α2C-adrenoceptor surface trafficking

    Article • Journal of Molecular Structure, November 2022, Elsevier

    Miss Maria Saeed

  2. 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

  3. Structure-Based Discovery of Potent Staphylococcus aureus Thymidylate Kinase Inhibitors by Virtual Screening

    Article • Medicinal Chemistry, April 2022, Bentham Science Publishers

    Miss Maria Saeed

  4. Effects of Smokeless Tobacco Samples from Tabuk Saudi Arabia on Nitric Oxide Production: A Potential Risk for Cancer and Cardiovascular Diseases

    Article • Current Computer - Aided Drug Design, April 2022, Bentham Science Publishers

    Miss Maria Saeed, Prof. Zaheer Ul-Haq, Izzaddinn Ahmed

  5. Relative assessment of different statistical instruments and measures for the prediction of promising outcomes using docking, virtual screening and ADMET analysis against HIV-RT

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

    Miss Maria Saeed, Dr Agha Zeeshan Mirza

  6. Protonation states at different pH, conformational changes and impact of glycosylation in synapsin Ia

    Article • Physical Chemistry Chemical Physics, January 2021, Royal Society of Chemistry

    Miss Maria Saeed

  7. Identification of potential TNF-α inhibitors: from in silico to in vitro studies

    Article • Scientific Reports, December 2020, Springer Science + Business Media

    Miss Maria Saeed

  8. Exploring the Molecular Mechanisms of 17β-HSD5-induced Carcinogenicity of Catha Edulis via Molecular Modeling Approach.

    Article • Medicinal Chemistry, October 2020, Bentham Science Publishers

    Prof. Zaheer Ul-Haq, Miss Maria Saeed

  9. Structural insight into TNF-α inhibitors through combining pharmacophore-based virtual screening and molecular dynamic simulation

    Article • Journal of Biomolecular Structure and Dynamics, July 2020, Taylor & Francis

    Miss Maria Saeed

  10. Anti-diarrheal activities of phytol along with its possible mechanism of action through in-vivo and in-silico models

    Article • Cellular and Molecular Biology, June 2020, CMB Association

    Miss Maria Saeed

  11. Pharmacophore model-based virtual screening, docking, biological evaluation and molecular dynamics simulations for inhibitors discovery against α-tryptophan synthase from Mycobacterium tuberculosis

    Article • Journal of Biomolecular Structure and Dynamics, January 2020, Taylor & Francis

    Miss Maria Saeed

  12. Using computational docking and virtual screening techniques the characterization of the Trypanosoma brucei pteridine reductase active-site

    Article • Current Computer - Aided Drug Design, August 2019, Bentham Science Publishers

    Dr Agha Zeeshan Mirza, Miss Maria Saeed

  13. Purification and Characterization of a Nonspecific Lipid Transfer Protein 1 (nsLTP1) from Ajwain (Trachyspermum ammi) Seeds

    Article • Scientific Reports, March 2019, Springer Science + Business Media

    Miss Maria Saeed

  14. 3D Structure Prediction of Human β1-Adrenergic Receptor via Threading-Based Homology Modeling for Implications in Structure-Based Drug Designing

    Article • PLoS ONE, April 2015, PLOS

    Prof. Zaheer Ul-Haq, Miss Maria Saeed

  15. Molecular docking- and genetic algorithm-based approaches to produce robust 3D-QSAR models

    Article • Medicinal Chemistry Research, October 2013, Springer Science + Business Media

    Prof. Zaheer Ul-Haq, Miss Maria Saeed