Computational Insights into the Mechanism of Nitric Oxide Generation from S-Nitrosoglutathione Catalyzed by a Copper Metal-Organic Framework

Keyphrases

• Nitric Oxide 100%
• Nitric Oxide Production 100%
• Cu(I) 100%
• S-nitrosoglutathione 100%
• Cu-MOF 100%
• Computational Insights 100%
• Metal-organic Frameworks (MOFs) 66%
• Density Functional Theory 33%
• Redox-active 33%
• Kinetic Data 33%
• Deprotonation 33%
• Sulfur 33%
• Benzene 33%
• Aqueous Solution 33%
• Tris 33%
• Reductive Elimination 33%
• Structural Stability 33%
• Vasodilatory 33%
• Catalytic Mechanism 33%
• 1H-1 33%
• Beneficial Properties 33%
• Controlled Generation 33%
• Functional Model 33%
• Catalytic Processes 33%
• Glutathione 33%
• High pH Value 33%
• Biomedical Implants 33%
• Endogenous Source 33%
• Framework Catalysts 33%
• Water-stable 33%
• Glutathione Disulfide 33%
• Triazole Linker 33%
• Mechanistic Insights 33%
• Copper Sites 33%
• Copper via 33%
• 1,2,3-triazol 33%

Chemistry

• Metal Organic Framework 100%
• S-Nitrosoglutathione 100%
• Nitric Oxide 100%
• Catalysis 60%
• Kinetics Type 20%
• Tris 20%
• Deprotonation 20%
• Reductive Elimination Reaction 20%
• Glutathione Disulfide 20%
• Implant 20%
• Aqueous Solution 20%
• Glutathione 20%
• Density Functional Theory 20%
• Catalyst 20%
• Nitrogen 20%
• Triazole 20%
• Benzene 20%

Material Science

• Nitric Oxide 100%
• Metal-Organic Framework 100%
• Catalysis 60%
• Glutathione 40%
• Density 20%
• Functional Modeling 20%
• Reductive Elimination 20%
• Catalyst 20%