Chemistry
Adenine
19%
Alkalinity
16%
Alkene
67%
Amino Acid
49%
Amino Group
15%
Ammonia
36%
Amyloid Fibril
29%
Aromatic Amino Acid
16%
Binding Energy
58%
Carbene
41%
Catalyst Activity
40%
CCSD
52%
Conformational Isomer
21%
Coordination Sphere
38%
cyclopropanation
24%
Cytosine
25%
Density Functional Theory
90%
Density Functional Theory
64%
DFT-B3LYP Calculation
88%
Donor
15%
Electronic State
59%
electronics
43%
Energy Barrier
45%
Enyne
21%
Enzymatic Hydrolysis
19%
First Principle
38%
formation
59%
Ground State
43%
Guanine
42%
Hydrogen
29%
Hydrogen Bond
34%
Imidazole
19%
Mass Spectrometry
27%
Metal Ion
100%
Nanoparticle
19%
Nitrogen Dioxide
48%
Nucleobase
19%
olefin metathesis
21%
Phe-His
15%
Phe-Tyr
15%
Point Group C2v
20%
Proton Affinity
19%
Proton Transfer
44%
protonation
24%
Purity
23%
Quantum Chemical Calculations
15%
Radical Cation
50%
Solvent Effect
20%
stability
69%
Vibrational Frequency
24%
Keyphrases
Alkene Metathesis
24%
Alkenes
24%
Alzheimer's Disease
42%
Amino Acids
33%
Amyloid Fibrils
21%
B3LYP
40%
B3LYP Functional
23%
Binding Energy
50%
Carbenes
36%
Catalytic Activity
29%
CCSD(T)
44%
Co2+
24%
Computational Approach
21%
Coordination Modes
23%
Coordination Properties
48%
Cu +
83%
Cu2+
98%
Cyclopropanation
22%
Density Functional
27%
Density Functional Method
33%
DFT Calculations
26%
Electronic Structure
26%
Energy Barrier
20%
Enynes
22%
First-principles Calculations
29%
Gas Phase
28%
Gas-phase Reactivity
38%
Glycine
69%
Grubbs
23%
Guanine
46%
Hoveyda-Grubbs Catalyst
19%
Hydrogen Peroxide
29%
IrO2
38%
Mass Spectrometry
23%
Metal Cations
46%
Metal Coordination
25%
Nanoparticles
20%
NH2 Groups
20%
Nucleobases
33%
Olefin Metathesis
21%
Olefins
25%
Oxygen Evolution Reaction
21%
Pentacoordinate
26%
Protonation
24%
Pt(II) Complexes
32%
Radical Cation
53%
Relative Stability
34%
Stable Structure
31%
Thioflavin T
38%
Vibrational Frequencies
25%
