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Synergistic Charge Transfer Effect in Ferrous Heme–CO Bonding within Cytochrome P450.
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- Molecules, 2024, v. 29, n. 4, p. 873, doi. 10.3390/molecules29040873
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Spectral features of the ferrous–CO complex in cytochrome P450: a revisit using TDDFT calculations.
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- Journal of Biological Inorganic Chemistry (JBIC), 2023, v. 28, n. 1, p. 57, doi. 10.1007/s00775-022-01985-w
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- Article
Energy Decomposition Analysis of the Nature of Coordination Bonding at the Heme Iron Center in Cytochrome P450 Inhibition.
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- Chemistry - An Asian Journal, 2022, v. 17, n. 13, p. 1, doi. 10.1002/asia.202200360
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Energy Decomposition Analysis of the Nature of Coordination Bonding at the Heme Iron Center in Cytochrome P450 Inhibition.
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- Chemistry - An Asian Journal, 2022, v. 17, n. 13, p. 1, doi. 10.1002/asia.202200360
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- Article
Controllable multiple-step configuration transformations in a thermal/photoinduced reaction.
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- Nature Communications, 2022, v. 13, n. 1, p. 1, doi. 10.1038/s41467-022-30597-w
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- Article
Theoretical Study on the Aliphatic C─H Bond Activation by a Mononuclear Manganese(III) Iodosylbenzene Complex.
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- Bulletin of the Korean Chemical Society, 2021, v. 42, n. 7, p. 1033, doi. 10.1002/bkcs.12300
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- Article
Titelbild: Direct Atomic‐Level Imaging of Zeolites: Oxygen, Sodium in Na‐LTA and Iron in Fe‐MFI (Angew. Chem. 44/2020).
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- Angewandte Chemie, 2020, v. 132, n. 44, p. 19529, doi. 10.1002/ange.202011447
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- Article
Direct Atomic‐Level Imaging of Zeolites: Oxygen, Sodium in Na‐LTA and Iron in Fe‐MFI.
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- Angewandte Chemie, 2020, v. 132, n. 44, p. 19678, doi. 10.1002/ange.202006122
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- Article
Cover Picture: Direct Atomic‐Level Imaging of Zeolites: Oxygen, Sodium in Na‐LTA and Iron in Fe‐MFI (Angew. Chem. Int. Ed. 44/2020).
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- Angewandte Chemie International Edition, 2020, v. 59, n. 44, p. 19361, doi. 10.1002/anie.202011447
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- Article
Direct Atomic‐Level Imaging of Zeolites: Oxygen, Sodium in Na‐LTA and Iron in Fe‐MFI.
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- Angewandte Chemie International Edition, 2020, v. 59, n. 44, p. 19510, doi. 10.1002/anie.202006122
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- Article
Fluorescein-Containing Superoxide Probes with a Modular Copper-Based Trigger.
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- ChemPlusChem, 2020, v. 85, n. 4, p. 653, doi. 10.1002/cplu.202000059
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- Article
Copper‐Catalyzed Asymmetric Arylation of N‐Heteroaryl Aldimines: Elementary Step of a 1,4‐Insertion.
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- Angewandte Chemie, 2019, v. 131, n. 9, p. 2731, doi. 10.1002/ange.201812646
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- Article
Copper‐Catalyzed Asymmetric Arylation of N‐Heteroaryl Aldimines: Elementary Step of a 1,4‐Insertion.
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- Angewandte Chemie International Edition, 2019, v. 58, n. 9, p. 2705, doi. 10.1002/anie.201812646
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- Article
Front Cover: Host–Guest Complexation Using Pillar[5]arene Crystals: Crystal‐Structure Dependent Uptake, Release, and Molecular Dynamics of an Alkane Guest (Chem. Eur. J. 10/2019).
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- Chemistry - A European Journal, 2019, v. 25, n. 10, p. 2375, doi. 10.1002/chem.201900219
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- Article
Host–Guest Complexation Using Pillar[5]arene Crystals: Crystal‐Structure Dependent Uptake, Release, and Molecular Dynamics of an Alkane Guest.
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- Chemistry - A European Journal, 2019, v. 25, n. 10, p. 2378, doi. 10.1002/chem.201900220
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- Article
Host–Guest Complexation Using Pillar[5]arene Crystals: Crystal‐Structure Dependent Uptake, Release, and Molecular Dynamics of an Alkane Guest.
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- Chemistry - A European Journal, 2019, v. 25, n. 10, p. 2497, doi. 10.1002/chem.201805733
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- Article
Molecular weight fractionation by confinement of polymer in one-dimensional pillar[5]arene channels.
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- Nature Communications, 2019, v. 10, n. 1, p. 1, doi. 10.1038/s41467-019-08372-1
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- Article
Facile Activation of Homoatomic σ Bonds in White Phosphorus and Diborane by a Diboraallene.
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- Angewandte Chemie, 2018, v. 130, n. 48, p. 15917, doi. 10.1002/ange.201808357
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- Article
Facile Activation of Homoatomic σ Bonds in White Phosphorus and Diborane by a Diboraallene.
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- Angewandte Chemie International Edition, 2018, v. 57, n. 48, p. 15691, doi. 10.1002/anie.201808357
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- Article
Palladium‐Catalyzed para‐Selective Alkylation of Electron‐Deficient Arenes.
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- Angewandte Chemie, 2018, v. 130, n. 21, p. 6402, doi. 10.1002/ange.201801967
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- Article
Palladium‐Catalyzed para‐Selective Alkylation of Electron‐Deficient Arenes.
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- Angewandte Chemie International Edition, 2018, v. 57, n. 21, p. 6294, doi. 10.1002/anie.201801967
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Analytical hessian fitting schemes for efficient determination of force-constant parameters in molecular mechanics.
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- Journal of Computational Chemistry, 2018, v. 39, n. 6, p. 307, doi. 10.1002/jcc.25100
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- Article
Separation of Linear and Branched Alkanes Using Host–Guest Complexation of Cyclic and Branched Alkane Vapors by Crystal State Pillar[6]arene.
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- Angewandte Chemie, 2018, v. 130, n. 6, p. 1608, doi. 10.1002/ange.201711575
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- Article
Separation of Linear and Branched Alkanes Using Host–Guest Complexation of Cyclic and Branched Alkane Vapors by Crystal State Pillar[6]arene.
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- Angewandte Chemie International Edition, 2018, v. 57, n. 6, p. 1592, doi. 10.1002/anie.201711575
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- Article
Cover Feature: The Dual Roles of Phenylenediamines: Using their Voltammetric Behavior to Measure the Hydrogen Donor and Acceptor Abilities of Alcohols in Acetonitrile (ChemPhysChem 24/2017).
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- ChemPhysChem, 2017, v. 18, n. 24, p. 3506, doi. 10.1002/cphc.201701292
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- Article
The Dual Roles of Phenylenediamines: Using their Voltammetric Behavior to Measure the Hydrogen Donor and Acceptor Abilities of Alcohols in Acetonitrile.
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- ChemPhysChem, 2017, v. 18, n. 24, p. 3562, doi. 10.1002/cphc.201700976
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Front Cover Picture: Acceptorless and Base-free Dehydrogenation of Cyanohydrin with (η<sup>6</sup>-Arene)halide(Bidentate Phosphine)ruthenium(II) Complex (Adv. Synth. Catal. 19/2017).
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- Advanced Synthesis & Catalysis, 2017, v. 359, n. 19, p. 3273, doi. 10.1002/adsc.201701132
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- Article
Acceptorless and Base-free Dehydrogenation of Cyanohydrin with (η<sup>6</sup>-Arene)halide(Bidentate Phosphine)ruthenium(II) Complex.
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- Advanced Synthesis & Catalysis, 2017, v. 359, n. 19, p. 3292, doi. 10.1002/adsc.201700786
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Highly Selective and Efficient Ring Hydroxylation of Alkylbenzenes with Hydrogen Peroxide and an Osmium(VI) Nitrido Catalyst.
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- Angewandte Chemie, 2017, v. 129, n. 40, p. 12428, doi. 10.1002/ange.201705986
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- Article
Highly Selective and Efficient Ring Hydroxylation of Alkylbenzenes with Hydrogen Peroxide and an Osmium(VI) Nitrido Catalyst.
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- Angewandte Chemie International Edition, 2017, v. 56, n. 40, p. 12260, doi. 10.1002/anie.201705986
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Using Voltammetry to Measure the Relative Hydrogen-Bonding Strengths of Pyridine and Its Derivatives in Acetonitrile.
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- ChemPhysChem, 2017, v. 18, n. 16, p. 2250, doi. 10.1002/cphc.201700560
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A reaction mode of carbene-catalysed aryl aldehyde activation and induced phenol OH functionalization.
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- Nature Communications, 2017, v. 8, n. 5, p. 15598, doi. 10.1038/ncomms15598
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Hydrodehalogenation of Haloarenes by a Sodium Hydride-Iodide Composite.
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- Angewandte Chemie, 2017, v. 129, n. 7, p. 1866, doi. 10.1002/ange.201611495
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Hydrodehalogenation of Haloarenes by a Sodium Hydride-Iodide Composite.
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- Angewandte Chemie International Edition, 2017, v. 56, n. 7, p. 1840, doi. 10.1002/anie.201611495
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Pd-Catalyzed, Ligand-Enabled Stereoselective 1,2-Iodine(III) Shift/1,1-Carboxyalkynylation of Alkynylbenziodoxoles.
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- Chemistry - A European Journal, 2017, v. 23, n. 7, p. 1521, doi. 10.1002/chem.201605772
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Selective and Catalyst-free Oxidation of D-Glucose to D-Glucuronic acid induced by High-Frequency Ultrasound.
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- Scientific Reports, 2017, p. 40650, doi. 10.1038/srep40650
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Dioxygen binding to Fe-MOF-74: microscopic insights from periodic QM/MM calculations.
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- Canadian Journal of Chemistry, 2016, v. 94, n. 12, p. 1144, doi. 10.1139/cjc-2016-0284
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- Article
Bisguanidinium dinuclear oxodiperoxomolybdosulfate ion pair-catalyzed enantioselective sulfoxidation.
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- Nature Communications, 2016, v. 7, n. 11, p. 13455, doi. 10.1038/ncomms13455
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Partial hessian fitting for determining force constant parameters in molecular mechanics.
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- Journal of Computational Chemistry, 2016, v. 37, n. 26, p. 2349, doi. 10.1002/jcc.24457
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- Article
The First Synthesis of the Sterically Encumbered Adamantoid Phosphazane P<sub>4</sub>(N<sup> t</sup>Bu)<sub>6</sub>: Enabled by Mechanochemistry.
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- Angewandte Chemie, 2016, v. 128, n. 41, p. 12928, doi. 10.1002/ange.201605936
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- Article
The First Synthesis of the Sterically Encumbered Adamantoid Phosphazane P<sub>4</sub>(N<sup> t</sup>Bu)<sub>6</sub>: Enabled by Mechanochemistry.
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- Angewandte Chemie International Edition, 2016, v. 55, n. 41, p. 12736, doi. 10.1002/anie.201605936
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- Article
Nickel-Catalyzed Enantioselective Reductive Amination of Ketones with Both Arylamines and Benzhydrazide.
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- Angewandte Chemie, 2016, v. 128, n. 39, p. 12262, doi. 10.1002/ange.201606821
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- Article
Nickel-Catalyzed Enantioselective Reductive Amination of Ketones with Both Arylamines and Benzhydrazide.
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- Angewandte Chemie International Edition, 2016, v. 55, n. 39, p. 12083, doi. 10.1002/anie.201606821
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- Article
Enantioselective Sulfoxidation Catalyzed by a Bisguanidinium Diphosphatobisperoxotungstate Ion Pair.
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- Angewandte Chemie, 2016, v. 128, n. 25, p. 7217, doi. 10.1002/ange.201601574
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- Article
Enantioselective Sulfoxidation Catalyzed by a Bisguanidinium Diphosphatobisperoxotungstate Ion Pair.
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- Angewandte Chemie International Edition, 2016, v. 55, n. 25, p. 7101, doi. 10.1002/anie.201601574
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- Article
Ambiphilic boron in 1,4,2,5-diazadiborinine.
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- Nature Communications, 2016, v. 7, n. 6, p. 11871, doi. 10.1038/ncomms11871
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Understanding the Origins of Nucleophilic Hydride Reactivity of a Sodium Hydride-Iodide Composite.
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- Chemistry - A European Journal, 2016, v. 22, n. 21, p. 7108, doi. 10.1002/chem.201600340
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Back Cover: Understanding the Origins of Nucleophilic Hydride Reactivity of a Sodium Hydride-Iodide Composite (Chem. Eur. J. 21/2016).
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- Chemistry - A European Journal, 2016, v. 22, n. 21, p. 7300, doi. 10.1002/chem.201601556
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Hydride Reduction by a Sodium Hydride-Iodide Composite.
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- Angewandte Chemie, 2016, v. 128, n. 11, p. 3783, doi. 10.1002/ange.201600305
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- Article
Hydride Reduction by a Sodium Hydride-Iodide Composite.
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- Angewandte Chemie International Edition, 2016, v. 55, n. 11, p. 3719, doi. 10.1002/anie.201600305
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- Article