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Molecules (Basel, Switzerland)|July 9, 2022
Deep Learning and Structure-Based Virtual Screening for Drug Discovery against NEK7: A Novel Target for the Treatment of CancerMubashir Aziz, Syeda Abida Ejaz, Seema Zargar, et al.Journal of Computer-Aided Molecular Design|November 25, 2025
Design, synthesis, pharmacological evaluation and computational modeling of 4-formyl-2-nitrophenyl quinoline-8-sulfonate derived thiosemicarbazones as antidiabetic agentsMuhammad Tayyab, Khalid Mahmood, Khawar Abbas, et al.Frontiers in Chemistry|January 8, 2024
Bioactive, antioxidant and antimicrobial properties of chemically fingerprinted essential oils extracted from Eucalyptus globulus: in-vitro and in-silico investigationsSaid Nasir Shah, Ibrar Khan, Sidra Tul Muntaha, et al.Heliyon|November 29, 2023
Demaghi, a polyherbal formulation, mitigates aluminum chloride-induced neurological impairment in mice: Insights from phytochemical analysis and behavioral assessmentHassan Ali, Hafiz Usman, Waseem Ashraf, et al.International Journal of Biological Macromolecules|May 5, 2024
Rutin-loaded zein gel as a green biocompatible formulation for wound healing applicationAgnese Gagliardi, Elena Giuliano, Silvia Voci, et al.Scientific Reports|August 28, 2023
Antioxidant and antimicrobial effects of essential oils from two salvia species with in vitro and in silico analysis targeting 1AJ6 and 1R4U proteinsSouad Maache, Latifa Zbadi, Asmae El Ghouizi, et al.Scientific Reports|November 17, 2023
Phytochemical analysis and biological activities of essential oils extracted from Origanum grossii and Thymus pallidus: in vitro and in silico analysisHind Zejli, Aziza Fitat, Youssra Lefrioui, et al.International Immunopharmacology|November 22, 2023
Synthesis, characterization, computational assay and anti-inflammatory activity of thiosemicarbazone derivatives: Highly potent and efficacious for COX inhibitorsKinza Saeed, Muhammad Rafiq, Muhammad Khalid, et al.Frontiers in Cellular and Infection Microbiology|September 21, 2023
Experimental and in silico evaluation of Carthamus tinctorius L. oil emulgel: a promising treatment for bacterial skin infectionsJavaria Saeed, Syed Nisar Hussain Shah, Hina Javed, et al.Biomolecules|November 11, 2022
Computational Investigation of 1, 3, 4 Oxadiazole Derivatives as Lead Inhibitors of VEGFR 2 in Comparison with EGFR: Density Functional Theory, Molecular Docking and Molecular Dynamics Simulation StudiesMuhammad Sajjad Bilal, Syeda Abida Ejaz, Seema Zargar, et al.Pageof 8