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Varish Ahmad, Alam Jamal, Mohammad Imran Khan, Faisal A. Alzahrani, Raed Albiheyri & Qazi Mohammad Sajid Jamal. (2023) Cefoperazone targets D-alanyl-D-alanine carboxypeptidase (DAC) to control Morganella morganii-mediated infection: a subtractive genomic and molecular dynamics approach. Journal of Biomolecular Structure and Dynamics 0:0, pages 1-14.
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Jahangir Ahmed, Irfan Navabshan, Sneha Unnikrishnan, Logesh Radhakrishnan, K.P. Kumaraguru Vasagam & Karthikeyan Ramalingam. (2023) In Silico and In Vitro Investigation of Phytochemicals Against Shrimp AHPND Syndrome Causing PirA/B Toxins of Vibrio parahaemolyticus. Applied Biochemistry and Biotechnology.
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Maxim S. Kondratyev, Vladimir R. Rudnev, Kirill S. Nikolsky, Denis V. Petrovsky, Liudmila I. Kulikova, Kristina A. Malsagova, Alexander A. Stepanov, Arthur T. Kopylov & Anna L. Kaysheva. (2022) In Silico Study of the Interactions of Anle138b Isomer, an Inhibitor of Amyloid Aggregation, with Partner Proteins. International Journal of Molecular Sciences 23:24, pages 16096.
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Nisha Govender, Norazura Syazlin Zulkifli, Nurul Farhana Badrul Hisham, Nur Syatila Ab Ghani & Zeti-Azura Mohamed-Hussein. (2022)
Pea eggplant (
Solanum torvum
Swartz) is a source of plant food polyphenols with SARS-CoV inhibiting potential
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Ahmed L. Alaofi, Mudassar Shahid, Mohammad Raish, Mushtaq Ahmad Ansari, Rabbani Syed & Mohd Abul Kalam. (2022) Identification of Doxorubicin as Repurposing Inhibitory Drug for MERS-CoV PLpro. Molecules 27:21, pages 7553.
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Ajaya Kumar Sahoo, Priya Dharshini Augusthian, Ishwarya Muralitharan, R. P. Vivek-Ananth, Kishan Kumar, Gaurav Kumar, Geetha Ranganathan & Areejit Samal. (2022) In silico identification of potential inhibitors of vital monkeypox virus proteins from FDA approved drugs. Molecular Diversity.
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Y-h. Taguchi & Turki Turki. (2022) Adapted tensor decomposition and PCA based unsupervised feature extraction select more biologically reasonable differentially expressed genes than conventional methods. Scientific Reports 12:1.
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Mohammed F. Abuzinadah, Varish Ahmad, Salwa Al-Thawdi, Shadi Ahmed Zakai & Qazi Mohammad Sajid Jamal. (2022) Exploring the Binding Interaction of Active Compound of Pineapple against Foodborne Bacteria and Novel Coronavirus (SARS-CoV-2) Based on Molecular Docking and Simulation Studies. Nutrients 14:15, pages 3045.
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Kaifu Gao, Rui Wang, Jiahui Chen, Limei Cheng, Jaclyn Frishcosy, Yuta Huzumi, Yuchi Qiu, Tom Schluckbier, Xiaoqi Wei & Guo-Wei Wei. (2022) Methodology-Centered Review of Molecular Modeling, Simulation, and Prediction of SARS-CoV-2. Chemical Reviews 122:13, pages 11287-11368.
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Pakorn Sagulkoo, Hathaichanok Chuntakaruk, Thanyada Rungrotmongkol, Apichat Suratanee & Kitiporn Plaimas. (2022) Multi-Level Biological Network Analysis and Drug Repurposing Based on Leukocyte Transcriptomics in Severe COVID-19: In Silico Systems Biology to Precision Medicine. Journal of Personalized Medicine 12:7, pages 1030.
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Priyanka Kumari, Bikram Pradhan, Maria Koromina, George P. Patrinos & Kristel Van Steen. (2022) Discovery of new drug indications for COVID-19: A drug repurposing approach. PLOS ONE 17:5, pages e0267095.
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Mohammad Azam Ansari, Muhammad Taha, Nizam Uddin, Fazal Rahim, Qazi Mohammad Sajid Jamal, Mohammad N. Alomary, Fahad M. Alshabrmi, Ahmad Almatroudi, Banan Atwah, Zain Alhindi, Naveed Iqbal & Khalid Mohammed Khan. (2022) Synthesis of indole-based oxadiazoles and their interaction with bacterial peptidoglycan and SARS-CoV-2 main protease: In vitro, molecular docking and in silico ADME/Tox study. Journal of Saudi Chemical Society 26:3, pages 101474.
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Elvan Üstün, Serpil Demir Düşünceli, Feyzullah Coşkun & İsmail Özdemir. (2021) Molybdenum Carbonyl Complexes with Benzimidazole Derivatives Against SARS-CoV-2 by Molecular Docking and DFT/TDDFT Methods. Journal of Computational Biophysics and Chemistry 20:08, pages 815-827.
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Wangsheng Deng, Jiaxing Zeng, Shunyu Lu & Chaoqian Li. (2021) Comprehensive investigation of RNA‐sequencing dataset reveals the hub genes and molecular mechanisms of coronavirus disease 2019 acute respiratory distress syndrome. IET Systems Biology 15:6, pages 205-218.
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Caterina Vicidomini, Valentina Roviello & Giovanni N. Roviello. (2021) In Silico Investigation on the Interaction of Chiral Phytochemicals from Opuntia ficus-indica with SARS-CoV-2 Mpro. Symmetry 13:6, pages 1041.
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