# Mpro data
# Galaxy histories (provenance information included)
Here are a list of Galaxy (opens new window) histories generated, one for each fragment structure reported by Diamond (opens new window). This list will be updated as more are completed.
History | Protein-fragment complex | Final ligands (147 MB) |
---|---|---|
Mpro-x0072 | scored, sorted ligands (opens new window) | |
Mpro-x0104 | scored, sorted ligands (opens new window) | |
Mpro-x0107 | scored, sorted ligands (opens new window) | |
Mpro-x0161 | scored, sorted ligands (opens new window) | |
Mpro-x0195 | scored, sorted ligands (opens new window) | |
Mpro-x0305 | scored, sorted ligands (opens new window) | |
Mpro-x0354 | scored, sorted ligands (opens new window) | |
Mpro-x0387 | scored, sorted ligands (opens new window) | |
Mpro-x0434 | scored, sorted ligands (opens new window) | |
Mpro-x0540 | scored, sorted ligands (opens new window) | |
Mpro-x0678 | scored, sorted ligands (opens new window) | |
Mpro-x0874 | scored, sorted ligands (opens new window) | |
Mpro-x0946 | scored, sorted ligands (opens new window) | |
Mpro-x0995 | scored, sorted ligands (opens new window) | |
Mpro-x1077 | scored, sorted ligands (opens new window) | |
Mpro-x1249 | scored, sorted ligands (opens new window) |
All in one history is available here (opens new window).
# Commandline download
Download all datasets from the commandline via wget
:
wget https://usegalaxy.eu/datasets/11ac94870d0bb33af9ff88ff05d7ac37/display?to_ext=sdf -O Mpro-x0072.sdf
wget https://usegalaxy.eu/datasets/11ac94870d0bb33a8e417ea0c6ac89a3/display?to_ext=sdf -O Mpro-x0104.sdf
wget https://usegalaxy.eu/datasets/11ac94870d0bb33a3d2d47263467aa39/display?to_ext=sdf -O Mpro-x0107.sdf
wget https://usegalaxy.eu/datasets/11ac94870d0bb33abe1b6cbc841cabee/display?to_ext=sdf -O Mpro-x0161.sdf
wget https://usegalaxy.eu/datasets/11ac94870d0bb33a7f567e7c1cda8dfd/display?to_ext=sdf -O Mpro-x0195.sdf
wget https://usegalaxy.eu/datasets/11ac94870d0bb33a8068598a0af2efb7/display?to_ext=sdf -O Mpro-x0305.sdf
wget https://usegalaxy.eu/datasets/11ac94870d0bb33abe0b0affbac4286a/display?to_ext=sdf -O Mpro-x0354.sdf
wget https://usegalaxy.eu/datasets/11ac94870d0bb33afdbeeb1be2406a75/display?to_ext=sdf -O Mpro-x0387.sdf
wget https://usegalaxy.eu/datasets/11ac94870d0bb33ae11f10f4abb2e6eb/display?to_ext=sdf -O Mpro-x0434.sdf
wget https://usegalaxy.eu/datasets/11ac94870d0bb33aa70734a58ac90aec/display?to_ext=sdf -O Mpro-x0540.sdf
wget https://usegalaxy.eu/datasets/11ac94870d0bb33a550be4e37e8e596a/display?to_ext=sdf -O Mpro-x0678.sdf
wget https://usegalaxy.eu/datasets/11ac94870d0bb33a5e644fe42c0d297d/display?to_ext=sdf -O Mpro-x0874.sdf
wget https://usegalaxy.eu/datasets/11ac94870d0bb33a896ad0c9ff85ddc1/display?to_ext=sdf -O Mpro-x0946.sdf
wget https://usegalaxy.eu/datasets/11ac94870d0bb33ad8b8cf8c82ef4627/display?to_ext=sdf -O Mpro-x0995.sdf
wget https://usegalaxy.eu/datasets/11ac94870d0bb33a8b8f3d747e35f32a/display?to_ext=sdf -O Mpro-x1077.sdf
wget https://usegalaxy.eu/datasets/11ac94870d0bb33aaf300ab710fe11e0/display?to_ext=sdf -O Mpro-x1249.sdf