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Physical Chemistry Chemical Physics : PCCP|May 24, 2024
Exploring the mechanism of action of spirooxindoles as a class of CDK2 inhibitors: a structure-based computational approachMuhammad Ikhlas Abdjan, Muhammad Shafiq, Dmitry Nerukh, et al.Pharmacognosy Magazine|December 5, 2017
Superoxide Scavenging and Antiglycation Activity of Rhinacanthins-rich Extract Obtained from the Leaves of Rhinacanthus nasutusMuhammad Ajmal Shah, Haji Muhammad, Yasir Mehmood, et al.Molecules (Basel, Switzerland)|May 5, 2015
Gd-Complexes of New Arylpiperazinyl Conjugates of DTPA-Bis(amides): Synthesis, Characterization and Magnetic Relaxation PropertiesAbdullah O Ba-Salem, Nisar Ullah, M Nasiruzzaman Shaikh, et al.Journal of Biomolecular Structure & Dynamics|February 23, 2021
Structure and ligand-based drug discovery of IL-4 inhibitors via interaction-energy-based learning approachesSehrish Naz, Sajda Ashraf, Mohammad K Parvez, et al.Scientific Reports|September 22, 2021
Exploration of the structural requirements of Aurora Kinase B inhibitors by a combined QSAR, modelling and molecular simulation approachSajda Ashraf, Kara E Ranaghan, Christopher J Woods, et al.Acta Pharmaceutica (Zagreb, Croatia)|July 23, 2020
In silico data mining of large-scale databases for the virtual screening of human interleukin-2 inhibitorsSobia Ahsan Halim, Zaheer-Ul-Haq, Ajmal Khan, et al.Molecular Diversity|February 25, 2025
Identification of effective synthetic molecules against viral-induced cytokine release syndrome using in silico and in vitro approachesHira Noor Malik, Almas Jabeen, Sajda Ashraf, et al.Journal of Biomolecular Structure & Dynamics|March 29, 2021
Relative assessment of different statistical instruments and measures for the prediction of promising outcomes using docking, virtual screening and ADMET analysis against HIV-RTHina Shamshad, Maria Saeed, Zaheer Ul-Haq, et al.Frontiers in Chemistry|June 27, 2022
Deciphering the Impact of Mutations on the Binding Efficacy of SARS-CoV-2 Omicron and Delta Variants With Human ACE2 ReceptorAlamgir Khan, Salman Ali Khan, Komal Zia, et al.Journal of Chemical Information and Modeling|August 22, 2025
Unveiling Ligand-Induced Conformational Changes in Mutant AR-LBD: Molecular Dynamics Insights into the Androgen Receptor-Coactivator MechanismMadiha Sardar, Nadeem Ahmad, Mamona Mushtaq, et al.Pageof 26