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Derya Osmaniye, Onur Yuva, Begüm Nurpelin Sağlık, Serkan Levent, Yusuf Ozkay & Zafer Asım Kaplancıklı. (2023) Design, synthesis, evaluation of biological activities and molecular docking and dynamic studies of novel acetazolamide analog compounds. Journal of Biomolecular Structure and Dynamics 0:0, pages 1-14.
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Yassir Boulaamane, Pallavi Kandpal, Anshuman Chandra, Mohammed Reda Britel & Amal Maurady. (2023) Chemical library design, QSAR modeling and molecular dynamics simulations of naturally occurring coumarins as dual inhibitors of MAO-B and AChE. Journal of Biomolecular Structure and Dynamics 0:0, pages 1-18.
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Rukaiyya Girase, Iqrar Ahmad & Harun Patel. (2023) Bioisosteric modification of Linezolid identified the potential M. tuberculosis protein synthesis inhibitors to overcome the myelosuppression and serotonergic toxicity associated with Linezolid in the treatment of the multi-drug resistance tuberculosis (MDR-TB). Journal of Biomolecular Structure and Dynamics 0:0, pages 1-16.
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A.K.M. Moyeenul Huq, Miah Roney, Syahrul Imran, Shafi Ullah Khan, Md. Nazim Uddin, Thet Thet Htar, Atif Amin Baig, Mohiuddin Ahmed Bhuiyan, Zainul Amiruddin Zakaria, Mohd Fadhlizil Fasihi Mohd Aluwi & Saiful Nizam Tajuddin. (2023) Virtual screening of bioactive anti-SARS-CoV natural products and identification of 3β,12-diacetoxyabieta-6,8,11,13-tetraene as a potential inhibitor of SARS-CoV-2 virus and its infection related pathways by MD simulation and network pharmacology. Journal of Biomolecular Structure and Dynamics 0:0, pages 1-14.
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Maryam N. ALNasser, Ayman M. AlSaadi, Alison Whitby, Dong-Hyun Kim, Ian R. Mellor & Wayne G. Carter. (2023) Acai Berry (Euterpe sp.) Extracts Are Neuroprotective against L-Glutamate-Induced Toxicity by Limiting Mitochondrial Dysfunction and Cellular Redox Stress. Life 13:4, pages 1019.
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Ulviye Acar Çevik, Ismail Celik, Ufuk İnce, Zahra Maryam, Iqrar Ahmad, Harun Patel, Yusuf Özkay & Zafer Asım Kaplancıklı. (2023) Synthesis, Biological Evaluation, and Molecular Modeling Studies of New 1,3,4‐Thiadiazole Derivatives as Potent Antimicrobial Agents. Chemistry & Biodiversity 20:3.
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Nisheeth C. Desai, Dharmpalsinh J. Jadeja, Aratiba M. Jethawa, Iqrar Ahmad, Harun Patel & B. P. Dave. (2023) Design and synthesis of some novel hybrid molecules based on 4-thiazolidinone bearing pyridine-pyrazole scaffolds: molecular docking and molecular dynamics simulations of its major constituent onto DNA gyrase inhibition. Molecular Diversity.
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Panwen Liu, Chenkang Wang, Wenhui Chen, Yu Kang, Weiwei Liu, Zhiyue Qiu, Toshihiko Hayashi, Kazunori Mizuno, Shunji Hattori, Hitomi Fujisaki & Takashi Ikejima. (2023) Inhibition of GluN2B pathway is involved in the neuroprotective effect of silibinin on streptozotocin-induced Alzheimer's disease models. Phytomedicine 109, pages 154594.
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Sachithra Thazhathuveedu Sudevan, Jong Min Oh, Mohamed A. Abdelgawad, Mohammed A. S. Abourehab, T. M. Rangarajan, Sunil Kumar, Iqrar Ahmad, Harun Patel, Hoon Kim & Bijo Mathew. (2022) Introduction of benzyloxy pharmacophore into aryl/heteroaryl chalcone motifs as a new class of monoamine oxidase B inhibitors. Scientific Reports 12:1.
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Sajal Kumar Halder, Iqrar Ahmad, Jannatul Fardous Shathi, Maria Mulla Mim, Md Rakibul Hassan, Md Johurul Islam Jewel, Piyali Dey, Md Sirajul Islam, Harun Patel, Md Reaz Morshed, Md Salman Shakil & Md Sakib Hossen. (2022) A Comprehensive Study to Unleash the Putative Inhibitors of Serotype2 of Dengue Virus: Insights from an In Silico Structure-Based Drug Discovery. Molecular Biotechnology.
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Suliman A. Alsagaby, Danish Iqbal, Iqrar Ahmad, Harun Patel, Shabir Ahmad Mir, Yahya Awaji Madkhali, Atif Abdulwahab A. Oyouni, Yousef M. Hawsawi, Fahad A. Alhumaydhi, Bader Alshehri, Wael Alturaiki, Bader Alanazi, Manzoor Ahmad Mir & Waleed Al Abdulmonem. (2022) In silico investigations identified Butyl Xanalterate to competently target CK2α (CSNK2A1) for therapy of chronic lymphocytic leukemia. Scientific Reports 12:1.
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Iqrar Ahmad, Rahul H. Pawara, Rukaiyya T. Girase, Asama Y. Pathan, Vilas R. Jagatap, Nisheeth Desai, Yusuf Oloruntoyin Ayipo, Sanjay J. Surana & Harun Patel. (2022) Synthesis, Molecular Modeling Study, and Quantum-Chemical-Based Investigations of Isoindoline-1,3-diones as Antimycobacterial Agents. ACS Omega 7:25, pages 21820-21844.
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