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Datasets:
Tc-43
/
GPR75_Inhibitor_Designs_GA-II

Tasks:
Tabular Regression
Graph Machine Learning
Other
Modalities:
Tabular
Text
Formats:
csv
Languages:
English
Size:
< 1K
Tags:
chemistry
biology
drug-discovery
molecular-docking
generative-design
gpcr
Libraries:
Datasets
pandas
Polars
License:
Dataset card Data Studio Files Files and versions
xet
Community
GPR75_Inhibitor_Designs_GA-II
24 MB
Ctrl+K
Ctrl+K
  • 1 contributor
History: 7 commits
Tc-43's picture
Tc-43
Drop the virtual-screening tag
7ed928f verified about 1 month ago
  • structures
    GPR75 vestibule GA-II designs: 139 docked complexes, ligands.sdf, receptor, dataset card about 2 months ago
  • .gitattributes
    2.5 kB
    initial commit about 2 months ago
  • README.md
    11.4 kB
    Drop the virtual-screening tag about 1 month ago
  • designs.csv
    52.8 kB
    GPR75 vestibule GA-II designs: 139 docked complexes, ligands.sdf, receptor, dataset card about 2 months ago
  • ligands.sdf
    511 kB
    GPR75 vestibule GA-II designs: 139 docked complexes, ligands.sdf, receptor, dataset card about 2 months ago
  • receptor_GPR75_inactive_model.pdb
    164 kB
    GPR75 vestibule GA-II designs: 139 docked complexes, ligands.sdf, receptor, dataset card about 2 months ago