Full description
PDB files with 10 tightest binding drug repurposing candidates bound to the main protease active site of SARS-CoV-2 from MD calculationsIssued: 2022-03-17
Created: 2022-03-17
Subjects
3CL |
Structural Biology (incl. Macromolecular Modelling) |
binding affinity |
computational chemistry |
docking |
main protease |
molecular dynamics |
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