Combinatorial computational method gives new picomolar ligands for a known enzyme

Keyphrases

• Computational Methods 100%
• R-enantiomer 100%
• Human Carbonic Anhydrase II 100%
• Small Molecules 50%
• Binding Affinity 50%
• Enantiomeric 50%
• Binding Mode 50%
• Computational Prediction 50%
• High Potency 50%
• Growth Algorithm 50%

Biochemistry, Genetics and Molecular Biology

• Enzyme 100%
• Human Carbonic Anhydrase II 100%
• Conformation 50%
• Small Molecule 50%
• Binding Affinity 50%

Pharmacology, Toxicology and Pharmaceutical Science

• Carbonate Dehydratase II 100%