Any feedback?
Please rate this page
(literature.php)
(0/150)

BRENDA support

Literature summary for 3.4.22.69 extracted from

  • De, P.; Bhayye, S.; Kumar, V.; Roy, K.
    In silico modeling for quick prediction of inhibitory activity against 3CLpro enzyme in SARS CoV diseases (2022), J. Biomol. Struct. Dyn., 40, 1010-1036 .
    View publication on PubMed

Application

Application Comment Organism
analysis quantitative structure-activity relationship model, molecular docking studies and molecular dynamics simulation to identify inhibitors, the model is applied to three large databases and reports top 25 compounds from each database Severe acute respiratory syndrome coronavirus 2

Organism

Organism UniProt Comment Textmining
Severe acute respiratory syndrome coronavirus 2 P0DTD1 replicase polyprotein 1ab
-