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Phytomedicine : International Journal of Phytotherapy and Phytopharmacology|June 15, 2023
Quinacrine inhibits HIF-1α/VEGF-A mediated angiogenesis by disrupting the interaction between cMET and ABCG2 in patient-derived breast cancer stem cellsBiswajit Das, Somya Ranjan Dash, Harun Patel, et al.RSC Advances|October 3, 2025
Identification of potential inhibitors of dihydrofolate reductase (DHFR) through blocking the folate biosynthetic pathway of Mycobacterium tuberculosis utilizing structure-based virtual screeningSajal Kumar Halder, Arafin Sultana, Iqrar Ahmad, et al.ACS Omega|July 5, 2022
Synthesis, Molecular Modeling Study, and Quantum-Chemical-Based Investigations of Isoindoline-1,3-diones as Antimycobacterial AgentsIqrar Ahmad, Rahul H Pawara, Rukaiyya T Girase, et al.Journal of Biomolecular Structure & Dynamics|May 15, 2023
In silico investigation and potential therapeutic approaches of isoquinoline alkaloids for neurodegenerative diseases: computer-aided drug design perspectiveRiyadh Ahmed Atto Al-Shuaeeb, H R Abd El-Mageed, Shimaa Ahmed, et al.International Journal of Molecular Sciences|October 13, 2021
Tomatidine and Patchouli Alcohol as Inhibitors of SARS-CoV-2 Enzymes (3CLpro, PLpro and NSP15) by Molecular Docking and Molecular Dynamics SimulationsRafat Zrieq, Iqrar Ahmad, Mejdi Snoussi, et al.ACS Omega|February 27, 2023
Development of Isopropyl-Tailed Chalcones as a New Class of Selective MAO-B Inhibitors for the Treatment of Parkinson's DisorderSunil Kumar, Jong Min Oh, Mohamed A Abdelgawad, et al.Scientific Reports|December 27, 2022
Introduction of benzyloxy pharmacophore into aryl/heteroaryl chalcone motifs as a new class of monoamine oxidase B inhibitorsSachithra Thazhathuveedu Sudevan, Jong Min Oh, Mohamed A Abdelgawad, et al.Journal of Biomolecular Structure & Dynamics|March 4, 2024
Computational and in vitro screening validates the repositioning potential of Coxibs as anti-fibrotic agentsShraddha Karande, Biswajit Das, Sushree Subhadra Acharya, et al.ACS Omega|April 29, 2024
Synthesis, DFT Calculations, In Silico Studies, and Antimicrobial Evaluation of Benzimidazole-Thiadiazole DerivativesAyşen Işık, Ulviye Acar Çevik, Arzu Karayel, et al.RSC Advances|February 27, 2026
Design, synthesis, molecular docking, and antimicrobial evaluation of hybrid peptides incorporating unnatural amino acids with enhanced hydrophobic sidechainsSubhash Rao Marata, Tushar Janardan Pawar, Jose Luis Olivares-Romero, et al.Pageof 11