| 1 |
QSAR, molecular docking, and molecular dynamics simulation–based design of novel anti-cancer drugs targeting thioredoxin reductase enzyme |
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| Mohammed Er-rajy, Mohamed El Fadili, Somdutt Mujwar, Fatima Zohra Lenda, Sara Zarougui, Menana Elhallaoui |
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| Structural Chemistry. 2023; |
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| [Pubmed] [Google Scholar] [DOI] |
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| 2 |
Synthesis and anticancer activity of 1,2,4-Benzothiadiazine-1,1-dioxides |
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| Sumit Chhabra, Kamal Shah |
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| Results in Chemistry. 2023; 5: 100873 |
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| [Pubmed] [Google Scholar] [DOI] |
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| 3 |
Design of novel anti-cancer drugs targeting TRKs inhibitors based 3D QSAR, molecular docking and molecular dynamics simulation |
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| Mohammed Er-rajy, Mohamed El fadili, Somdutt Mujwar, Sara Zarougui, Menana Elhallaoui |
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| Journal of Biomolecular Structure and Dynamics. 2023; : 1 |
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| [Pubmed] [Google Scholar] [DOI] |
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| 4 |
Computational Design of Plant-Based Antistress Agents Targeting Nociceptin Receptor |
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| Vishal Sharma, Somdutt Mujwar, Diksha Sharma, Rina Das, Dinesh Kumar Mehta, Kamal Shah |
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| Chemistry & Biodiversity. 2023; |
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| [Pubmed] [Google Scholar] [DOI] |
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| 5 |
Microbial isolation and characterization of arsenic degrading microbes from soil and its RAPD analysis for bioremediation |
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| Kaushika Shanmugam, Kalaivani Kumar, Srinisha Abhimanyu, SriSowmiya Selvaraju, BSri Lakshmi Narayana, RS Sharanprasath, TNaveen Kumar, R Manikandan, SHari bala |
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| Biomedical and Biotechnology Research Journal (BBRJ). 2023; 7(1): 93 |
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| [Pubmed] [Google Scholar] [DOI] |
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| 6 |
Repurposing benzbromarone as antifolate to develop novel antifungal therapy for Candida albicans |
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| Somdutt Mujwar, Avanish Tripathi |
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| Journal of Molecular Modeling. 2022; 28(7) |
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| [Pubmed] [Google Scholar] [DOI] |
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| 7 |
In silico bioprospecting of taraxerol as a main protease inhibitor of SARS-CoV-2 to develop therapy against COVID-19 |
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| Somdutt Mujwar, Ranjit K. Harwansh |
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| Structural Chemistry. 2022; |
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| [Pubmed] [Google Scholar] [DOI] |
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| 8 |
Computational Design of Phosphatidylinositol 3-Kinase Inhibitors |
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| Isha Rani, Anju Goyal, M. Sharma |
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| ASSAY and Drug Development Technologies. 2022; 20(7): 317 |
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| [Pubmed] [Google Scholar] [DOI] |
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| 9 |
Computational Design, Synthesis, and Pharmacological Evaluation of Naproxen-Guaiacol Chimera for Gastro-Sparing Anti-Inflammatory Response by Selective COX2 Inhibition |
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| Pottathil Shinu, Manu Sharma, Girdhari Lal Gupta, Somdutt Mujwar, Mahmoud Kandeel, Manish Kumar, Anroop B. Nair, Manoj Goyal, Purna Singh, Mahesh Attimarad, Katharigatta N. Venugopala, Sreeharsha Nagaraja, Mallikarjun Telsang, Bandar E. Aldhubiab, Mohamed A. Morsy |
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| Molecules. 2022; 27(20): 6905 |
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| [Pubmed] [Google Scholar] [DOI] |
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| 10 |
Computational Bioprospecting Guggulsterone against ADP Ribose Phosphatase of SARS-CoV-2 |
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| Mateusz Kciuk, Somdutt Mujwar, Isha Rani, Kavita Munjal, Adrianna Gielecinska, Renata Kontek, Kamal Shah |
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| Molecules. 2022; 27(23): 8287 |
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| [Pubmed] [Google Scholar] [DOI] |
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