SMIREP: Predicting Chemical Activity from SMILES

Keyphrases

• Estrogen Receptor 100%
• Structure-activity Relationship 100%
• Chemical Activity 100%
• Highly Accurate 50%
• Binding Activity 50%
• Prediction Accuracy 50%
• Small Sets 50%
• Model Generation 50%
• Large Set 50%
• Predictive Models 50%
• Machine Learning Techniques 50%
• Environmental Fate 50%
• Data Mining Techniques 50%
• State-of-the-art Techniques 50%
• Biodegradability 50%
• Mutagenicity 50%
• National Center 50%
• Carcinogenic Potency 50%
• Toxicological Research 50%
• Alternative States 50%
• Relationship Prediction 50%
• Distributed Structure 50%
• Rules of Interpretation 50%
• SMILES Strings 50%
• Rule Learner 50%
• Environmental Protection Agency 50%
• Fragment Generation 50%
• Computational Chemists 50%
• If-then Rules 50%

Computer Science

• Predictive Model 100%
• Machine Learning Technique 100%
• Model Generation 100%
• Predictive Accuracy 100%
• Data Mining Technique 100%
• Distributed Agency 100%

Pharmacology, Toxicology and Pharmaceutical Science

• Estrogen Receptor 100%
• Structure Activity Relationship 100%
• Mutagenicity 50%