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Iron compounds
Hemoglobin
2
Acid catalysis
1
Aliphatic diazonium ions
1
Amines
1
Amino acids
1
Aromatic compounds
1
B3LYP
1
Basic mechanism
1
Calculations
1
Carbocation
1
Catalysis
1
Complexation
1
Computer Simulation
1
Coordination reactions
1
DFT
1
Discrete Fourier transforms (DFT)
1
Electronic density of states
1
Electronic structure
1
Energy gap
1
Fourier transforms
1
Ground state
1
Hartree-Fock methodologies
1
Heme
1
Hydrogen Bonding
1
Hydrogen bonds
1
Hydroxide anions
1
Ions
1
Iron porphyrin
1
Mathematical models
1
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2JOUR
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3