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. 2021 Jul 29;11:15431. doi: 10.1038/s41598-021-92176-1

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© The Author(s) 2021

Open Access This article is licensed under a Creative Commons Attribution 4.0 International License, which permits use, sharing, adaptation, distribution and reproduction in any medium or format, as long as you give appropriate credit to the original author(s) and the source, provide a link to the Creative Commons licence, and indicate if changes were made. The images or other third party material in this article are included in the article's Creative Commons licence, unless indicated otherwise in a credit line to the material. If material is not included in the article's Creative Commons licence and your intended use is not permitted by statutory regulation or exceeds the permitted use, you will need to obtain permission directly from the copyright holder. To view a copy of this licence, visit http://creativecommons.org/licenses/by/4.0/.

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Molecular dynamic simulation result of the multi-epitope vaccine, and TLR-4 (red), TLR-2 (black) complexes at 50 ns. (A) The RMSD plot of the c-alpha atoms of the complexes. The mild fluctuations represent the stability of the complexes. (B) The Rg (Radius of Gyration) plot. (C) The Hydrogen bond (HB) plot of vaccine and TLRs docked complexes. (D) The SASA (Solvent-Accessible Surface Area) profile of the docked complexes.