Group deposition SARS-CoV-2 main protease in complex with inhibitors from the COVID Moonshot -- Crystal Structure of SARS-CoV-2 main protease in complex with EDJ-MED-8c98ee63-2 (Mpro-P0224)
Data for "Expanding the scope of a catalogue search to bioisosteric fragment merges using a graph database approach" Contains files with the SMILES retrieved from the database (fragnet_query_outputs.