Benchmark data sets for structure-based computational target prediction. [electronic resource]
Producer: 20150512Description: 2261-74 p. digitalISSN:- 1549-960X
- Algorithms
- Benchmarking
- Binding Sites
- Crystallography, X-Ray
- Datasets as Topic
- Enzyme Inhibitors -- chemistry
- Histone Deacetylases -- chemistry
- Humans
- Ligands
- Molecular Docking Simulation
- Phosphoric Diester Hydrolases -- chemistry
- Protein Binding
- Protein Conformation
- Serine Proteases -- chemistry
- Small Molecule Libraries -- chemistry
- Structure-Activity Relationship
- Thermodynamics
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Publication Type: Journal Article
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