Version 2 2021-08-24, 16:46Version 2 2021-08-24, 16:46
Version 1 2021-05-25, 11:57Version 1 2021-05-25, 11:57
dataset
posted on 2021-08-24, 16:46authored byPiotr PanethPiotr Paneth, Monika Rola, Jakub Krassowski, Julita Górska, Anna Grobelna, Wojciech Płonka, Agata Paneth
1. Structures
(in smiles format), and FlexX, Vina, HYDE, and ChemPLP docking scores of docking 1820 aminothioureas to the SARS-CoV-2 S-protein – human ACE2 interface
Funding
supported in part by the Foundation for Polish Science via the grant MAB PLUS/2019/11.