Title : In silico screening of the effectiveness of natural compounds from algae as SARS-CoV-2 inhibitors: molecular docking, ADMT profile and molecular dynamic studies.

Pub. Date : 2022 Mar 7

PMID : 35253618






1 Functional Relationships(s)
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1 Among the algal compounds screened in this study, three (Laminarin, Astaxanthin and 4"-chlorostypotriol triacetate) exhibited the lowest docking energy and best interaction with SARS-CoV-2 viral proteins (Main protease, RdRp, Nsp15, and spike protein). laminaran ORF1a polyprotein;ORF1ab polyprotein Severe acute respiratory syndrome coronavirus 2