A comprehensive computational study of Millets derived phytochemicals as potential inhibitors of NACHT domain of NLRP3 inflammasome: Molecular docking, molecular dynamics simulation, MM-PBSA free energy calculation and DFT analysis.
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| Title: | A comprehensive computational study of Millets derived phytochemicals as potential inhibitors of NACHT domain of NLRP3 inflammasome: Molecular docking, molecular dynamics simulation, MM-PBSA free energy calculation and DFT analysis. |
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| Authors: | Nalban, Nasiruddin1 nasiruddincsir@gmail.com, Wanjari, Manish1 manish.nriashrd@gmail.com, Matte, Sudhir1, Jamadagni, Pallavi1, Tamboli, Munaf1 |
| Source: | Indian Journal of Biochemistry & Biophysics. Apr2024, Vol. 61 Issue 4, p223-231. 9p. |
| Database: | Academic Search Ultimate |
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