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Computation-Assisted Identification of Bioactive Compounds in Botanical Extracts: A Case Study of Anti-Inflammatory Natural Products from Hops.
Antioxidants (Basel). 2022 Jul 19;11(7):1400. doi: 10.3390/antiox11071400.
Antioxidants (Basel). 2022.
PMID: 35883889
Free PMC article.
Integrating High-Resolution Mass Spectral Data, Bioassays and Computational Models to Annotate Bioactives in Botanical Extracts: Case Study Analysis of C. asiatica Extract Associates Dicaffeoylquinic Acids with Protection against Amyloid-β Toxicity.
Alcázar Magaña A, Vaswani A, Brown KS, Jiang Y, Alam MN, Caruso M, Lak P, Cheong P, Gray NE, Quinn JF, Soumyanath A, Stevens JF, Maier CS.
Alcázar Magaña A, et al.
Molecules. 2024 Feb 13;29(4):838. doi: 10.3390/molecules29040838.
Molecules. 2024.
PMID: 38398590
Free PMC article.
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