Materias dentro de su búsqueda.
Materias dentro de su búsqueda.
article
5
chemical reaction
4
nitric oxide
4
unclassified drug
4
DFT calculation
3
Hydrogen bonds
3
Models, Chemical
3
calculation
3
density functional theory
3
Binding Sites
2
Computer Simulation
2
Density functional theory
2
Electronic structure
2
Ferrous Compounds
2
Free radicals
2
Hemoglobin
2
Ligands
2
Nitric Oxide
2
Nitric oxide
2
Pentafluorophenyl
2
Porphyrins
2
Probability density function
2
Quantum theory
2
Reduction
2
Thermodynamics
2
chemical structure
2
complex formation
2
electron transport
2
porphyrin
2
reaction analysis
2
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1Materias: “...DFT calculation...”
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2Materias: “...density functional calculations...”
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3Materias: “...Electronic structure calculations...”
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4Materias: “...calculation...”
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5Materias: “...Quantum-mechanical calculation...”
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6Materias: “...calculation...”
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7Materias: “...calculation...”
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8por Suarez, S.A., Muñoz, M., Alvarez, L., Venâncio, M.F., Rocha, W.R., Bikiel, D.E., Marti, M.A., Doctorovich, F.Materias: “...ab initio calculation...”
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9Materias: “...DFT calculation...”
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