Frequent substructure-based approaches for classifying chemical compounds

Mathematics

• Substructure 83%
• Percent 43%
• Classification Problems 39%
• Drugs 36%
• Subgraph 29%
• Experimental Evaluation 25%
• Classification Algorithm 25%
• Feature Selection 23%
• Scalability 23%
• Pharmaceuticals 22%
• Computational Techniques 21%
• Classifier 20%
• Libraries 19%
• Filtering 17%
• Assign 17%
• Model 17%
• Class 5%

Engineering & Materials Science

• Chemical compounds 100%
• Drug Development 20%
• Bioactivity 19%
• Drug products 15%
• Scalability 11%
• Feature extraction 10%
• Classifiers 10%