All Stories

  1. Nitric Oxide Insertion into a Metalloporphyrin–Carbon Bond
  2. Oxidative HNO Formation Mechanisms from NH 2 OH via Two Different Heme Proteins and Effects from Hemes, Nearby Residues, and Protein Environments
  3. Computational Mechanistic Investigation of Biocatalytic C(sp3)–H Insertions with Monosubstituted Carbenes via Engineered Heme Proteins
  4. Oxidative and Hydrolytic HNO Formation from a Clinical Drug Hydroxyurea Catalyzed by Horseradish Peroxidase: Basic Mechanism, Active Site Effect, and Implications for Drug Design
  5. Alternative Metal with an Alternative Mechanism for Metalloporphyrin-Enabled NO Reduction to N2O: A Combined Computational and Experimental Investigation of NO Reduction by Cr Porphyrin with Lewis Acid
  6. A comprehensive mechanistic investigation of sustainable carbene N–H insertion catalyzed by engineered His-ligated heme proteins
  7. Heme-based catalysis for sustainable carbene transfer chemistry: computational mechanistic investigations
  8. Mechanistic investigation of sustainable heme-inspired biocatalytic synthesis of cyclopropanes for challenging substrates
  9. One‐Electron NO to N2O Pathways via Heme Models and Lewis Acid: Metal Effects and Differences from the Enzymatic Reaction
  10. Biocatalytic Carbenoid N-H Insertions Via Engineered Myoglobins: A Systematic Reaction Mechanism Study
  11. Stereodivergent Synthesis of Pyridyl Cyclopropanes via Enzymatic Activation of Pyridotriazoles
  12. Reusable HNO Sensors Derived from Cu Cyclam: A DFT Study on the Mechanistic Origin of High Reactivity and Favorable Conformation Changes and Potential Improvements
  13. Mechanistic manifold in a hemoprotein-catalyzed cyclopropanation reaction with diazoketone
  14. Generation and Application of Homoallylic α,α‐Diboryl Radicals via Diboron‐Promoted Ring‐Opening of Vinyl Cyclopropanes: cis‐Diastereoselective Borylative Cycloaddition**
  15. Biocatalytic Intramolecular C-H Aminations Via Engineered Heme Proteins: Full Reaction Pathways and Axial Ligand Effects
  16. Computational Mechanistic Investigations of Biocatalytic Nitrenoid C−H Functionalizations via Engineered Heme Proteins
  17. Liposome‐Templated Green Synthesis of Mesoporous Metal Nanostructures with Universal Composition for Biomedical Application
  18. Mechanistic Manifold in a Hemoprotein-Catalyzed Cyclopropanation Reaction with Diazoketone
  19. Mechanistic Origin of Favorable Substituent Effects in Excellent Cu Cyclam Based HNO Sensors
  20. Mechanistic Origin of Favorable Substituent Effects in Excellent Cu Cyclam Based HNO Sensors
  21. Biocatalytic Intramolecular C−H aminations via Engineered Heme Proteins: Full Reaction Pathways and Axial Ligand Effects
  22. Insights into the Observed trans-Bond Length Variations upon NO Binding to Ferric and Ferrous Porphyrins with Neutral Axial Ligands
  23. Synergistic NO Coupling By Heme and Lewis Acid
  24. HNO to NO Conversion Mechanism with Copper Zinc Superoxide Dismutase, Comparison with Heme Protein Mediated Conversions, and the Origin of Questionable Reversibility
  25. Insight into the preferential N-binding versus O-binding of nitrosoarenes to ferrous and ferric heme centers
  26. Stepwise nitrosylation of the nonheme iron site in an engineered azurin and a molecular basis for nitric oxide signaling mediated by nonheme iron proteins
  27. The oxygen reactivity of an artificial hydrogenase designed in a reengineered copper storage protein
  28. Not Limited to Iron: A Cobalt Heme-NO Model Facilitates N-N Coupling with External NO in the Presence of a Lewis Acid to Generate N2 O
  29. Not Limited to Iron: A Cobalt Heme–NO Model Facilitates N–N Coupling with External NO in the Presence of a Lewis Acid to Generate N 2 O
  30. Frontispiece: Computational Investigations of Heme Carbenes and Heme Carbene Transfer Reactions
  31. Computational Investigations of Heme Carbenes and Heme Carbene Transfer Reactions
  32. Biocatalytic Strategy for Highly Diastereo‐ and Enantioselective Synthesis of 2,3‐Dihydrobenzofuran‐Based Tricyclic Scaffolds
  33. Biocatalytic Strategy for Highly Diastereo- and Enantioselective Synthesis of 2,3-Dihydrobenzofuran-Based Tricyclic Scaffolds
  34. Mechanistic Investigation of Biocatalytic Heme Carbenoid Si−H Insertions
  35. Redesign of a Copper Storage Protein into an Artificial Hydrogenase
  36. Synthesis, Characterization, and Theoretical Investigation of a Transition State Analogue for Proton Transfer during C–H Activation by a Rhodium-Pincer Complex
  37. Origin of High Stereocontrol in Olefin Cyclopropanation Catalyzed by an Engineered Carbene Transferase
  38. Mechanisms of HNO Reactions with Ferric Heme Proteins
  39. Mechanisms of HNO Reactions with Ferric Heme Proteins
  40. Nitrosyl Myoglobins and Their Nitrite Precursors: Crystal Structural and Quantum Mechanics and Molecular Mechanics Theoretical Investigations of Preferred Fe–NO Ligand Orientations in Myoglobin Distal Pockets
  41. Periodic Trends Manifested through Gas-Phase Generation of Anions Such as [AlH4]−, [GaH4]−, [InH4]−, [SrH3]−, [BaH3]−, [Ba(0)(η2-O2CH)1]−, [Pb(0)H]−, [Bi(I)H2]−, and Bi– from Formates
  42. Lewis Acid Activation of the Ferrous Heme–NO Fragment toward the N–N Coupling Reaction with NO To Generate N2O
  43. Cyclopropanations via Heme Carbenes: Basic Mechanism and Effects of Carbene Substituent, Protein Axial Ligand, and Porphyrin Substitution
  44. Frontispiece: C−H Insertions by Iron Porphyrin Carbene: Basic Mechanism and Origin of Substrate Selectivity
  45. C−H Insertions by Iron Porphyrin Carbene: Basic Mechanism and Origin of Substrate Selectivity
  46. Manganese and Cobalt in the Nonheme-Metal-Binding Site of a Biosynthetic Model of Heme-Copper Oxidase Superfamily Confer Oxidase Activity through Redox-Inactive Mechanism
  47. Why copper is preferred over iron for oxygen activation and reduction in haem-copper oxidases
  48. HNO-Binding in Heme Proteins: Effects of Iron Oxidation State, Axial Ligand, and Protein Environment
  49. HNO-Binding in Heme Proteins: Effects of Iron Oxidation State, Axial Ligand, and Protein Environment
  50. Competitive homolytic and heterolytic decomposition pathways of gas-phase negative ions generated from aminobenzoate esters
  51. Hydride Attack on a Coordinated Ferric Nitrosyl: Experimental and DFT Evidence for the Formation of a Heme Model–HNO Derivative
  52. Ambulation of Incipient Proton during Gas-Phase Dissociation of Protonated Alkyl Dihydrocinnamates
  53. Toward Relatively General and Accurate Quantum Chemical Predictions of Solid-State 17O NMR Chemical Shifts in Various Biologically Relevant Oxygen-Containing Compounds
  54. Catalytic and Biocatalytic Iron Porphyrin Carbene Formation: Effects of Binding Mode, Carbene Substituent, Porphyrin Substituent, and Protein Axial Ligand
  55. 77Se Chemical Shift Tensor of l-Selenocystine: Experimental NMR Measurements and Quantum Chemical Investigations of Structural Effects
  56. Solid-State17O NMR Spectroscopy of Paramagnetic Coordination Compounds
  57. The fluorescence regulation mechanism of the paramagnetic metal in a biological HNO sensor
  58. A Distonic Radical-Ion for Detection of Traces of Adventitious Molecular Oxygen (O2) in Collision Gases Used in Tandem Mass Spectrometers
  59. Selectivity of gas-phase ion/molecule reaction of carbon dioxide with phenide ions
  60. Exploring Bis(cyclometalated) Ruthenium(II) Complexes as Active Catalyst Precursors: Room-Temperature Alkene-Alkyne Coupling for 1,3-Diene Synthesis
  61. Iron Porphyrin Carbenes as Catalytic Intermediates: Structures, Mössbauer and NMR Spectroscopic Properties, and Bonding
  62. Insights into the Binding of Pyridines to the Iron–Sulfur Enzyme IspH
  63. HNO/NO Conversion Mechanisms of Cu-Based HNO Probes with Implications for Cu,Zn-SOD
  64. Spectroscopic and Computational Study of a Nonheme Iron Nitrosyl Center in a Biosynthetic Model of Nitric Oxide Reductase
  65. Direct Detection of Solid Inorganic Mercury Salts at Ambient Pressure by Electron-Capture and Reaction-Assisted HePI Mass Spectrometry
  66. Isoprenoid Biosynthesis: Ferraoxetane or Allyl Anion Mechanism for IspH Catalysis?
  67. Photo-induced isomerization of ethylene-bridged azobenzene explored by ab initio based non-adiabatic dynamics simulation: A comparative investigation of the isomerization in the gas and solution phases
  68. Computational investigations of HNO in biology
  69. Iron Binding Site in a Global Regulator in Bacteria–Ferric Uptake Regulator (Fur) Protein: Structure, Mössbauer Properties, and Functional Implication
  70. Structure, function and inhibition of the two- and three-domain 4Fe-4S IspG proteins
  71. Differential SERS Activity of Gold and Silver Nanostructures Enabled by Adsorbed Poly(vinylpyrrolidone)
  72. Metal centre effects on HNO binding in porphyrins and the electronic origin: metal's electronic configuration, position in the periodic table, and oxidation state
  73. Design, Synthesis, and X-ray Crystallographic Analysis of a Novel Class of HIV-1 Protease Inhibitors
  74. Probing Highly Efficient Photoisomerization of a Bridged Azobenzene by a Combination of CASPT2//CASSCF Calculation with Semiclassical Dynamics Simulation
  75. HNO Binding in a Heme Protein: Structures, Spectroscopic Properties, and Stabilities
  76. Enzyme Reactivation by Hydrogen Peroxide in Heme-based Tryptophan Dioxygenase
  77. Metallic nitride azafullerenes: A novel class of fullerenes with interesting electronic properties
  78. Structural, EPR Superhyperfine, and NMR Hyperfine Properties of the Cu−Octarepeat Binding Site in the Prion Protein
  79. Conformational and configurational analysis of an N,N carbonyl dipyrrinone-derived oximate and nitrone by NMR and quantum chemical calculations