Application of spice compounds in preparation of hygienic product for inhibiting infectivity of novel coronavirus
A hygienic product, coronavirus technology, applied in the application field of hygienic products, can solve the problem that there is no specific monomer compound drug and so on
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Embodiment 1
[0025] Example 1: Molecular docking of fragrance compounds with the potential target S protein of 2019-nCoV
[0026] Download the 3D structure files of fragrance compounds in sdf format from the website https: / / pubchem.ncbi.nlm.nih.gov / supported by the National Institutes of Health and maintained by the National Center for Biotechnology Information. The 3D conformation was then optimized with Avogadro software and saved in pdb format. Finally, assign relevant charges through Autodock Tools, automatically set twistable keys, and export to pdbqt format file.
[0027] The S protein adopts the pdbqt format file downloaded from the new coronavirus drug target structure information sharing platform system of the Qingdao State Key Laboratory of Marine Science and Technology, and runs autodock vina for molecular docking. The docking parameters:
[0028] center_x=-32.81
[0029] center_y=25.66
[0030] center_z=4.79
[0031] size_x=23
[0032] size_y=21
[0033] size_z=21
[00...
Embodiment 2
[0044] Example 2: Liquid Fragrance (Isoamyl Salicylate)
[0045] Quantitatively weigh 2.00% of isoamyl salicylate and 98.00% of medical alcohol, mix and stir to obtain.
Embodiment 3
[0046] Example 3: Liquid Fragrance (Bisabolenyl)
[0047] Quantitatively weigh 1.00% of bisabolene and 99.00% of medical alcohol, mix and stir evenly to obtain the obtained product.
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