Keyphrases
Reaction Mechanism
100%
DFT Study
100%
Methylglyoxal
100%
Aminoguanidine
100%
Phosphatidylethanolamine
80%
Dehydration
60%
Methyl
20%
Hydrogen Bond Network
20%
Rate-determining Step
20%
Explicit Water
20%
Ring Closure
20%
Intramolecular Proton Transfer
20%
Water Solvent
20%
Intermediate State
20%
Transition State
20%
Biomolecules
20%
Four-step
20%
Transition State Structure
20%
Dicarbonyl Compounds
20%
Free Energy Profile
20%
Microkinetics
20%
Dicarbonyls
20%
Condensation
20%
3-Amino-1,2,4-triazine
20%
Intermediate Structure
20%
1,2,4-triazine Derivatives
20%
Apparent Activation Energy
20%
Guanylhydrazone
20%
DMol3
20%
Autoxidation
20%
DFT Calculations
20%
Chemistry
Density Functional Theory
100%
Methylglyoxal
100%
Aminoguanidine
100%
Phosphatidylethanolamine
80%
1,2,4-triazine
40%
Reaction Activation Energy
20%
Hydrogen Bonding
20%
Proton Transfer
20%
Rate-Determining Step
20%
Condensation
20%
Transition State
20%
Transition State Structure
20%
Gibbs Free Energy
20%
Pharmacology, Toxicology and Pharmaceutical Science
Aminoguanidine
100%
Methylglyoxal
100%
Phosphatidylethanolamine
80%
Hydrogen Bond
20%
Triazine
20%
Triazine Derivative
20%
Amidinohydrazone
20%
Amphetaminil
20%
Biochemistry, Genetics and Molecular Biology
Phosphatidylethanolamine
100%
Methylglyoxal
100%
Surface Property
50%
Hydrogen Bond
25%
Proton Transport
25%
Autooxidation
25%