Bioorganometallic chemistry: Co-factor regeneration, enzyme recognition of biomimetic 1,4-NADH analogs, and organic synthesis; tandem catalyzed regioselective formation of N-substituted-1,4-dihydronicotinamide derivatives with [Cp*Rh(bpy)H]+, coupled to chiral S-alcohol formation with HLADH, and engineered cytochrome P450s, for selective C-H oxidation reactions
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June 2017 |
Biocatalyst–artificial metalloenzyme cascade based on alcohol dehydrogenase
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January 2018 |
Horse Liver Alcohol Dehydrogenase: Zinc Coordination and Catalysis
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July 2017 |
Cyclopentadiene-mediated hydride transfer from rhodium complexes
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January 2016 |
Enzymes useful for chiral compound synthesis: structural biology, directed evolution, and protein engineering for industrial use
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May 2016 |
Atomic-Resolution Structures of Horse Liver Alcohol Dehydrogenase with NAD + and Fluoroalcohols Define Strained Michaelis Complexes
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May 2012 |
Multistep One-Pot Reactions Combining Biocatalysts and Chemical Catalysts for Asymmetric Synthesis
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November 2013 |
Stereoselective biocatalysis: A mature technology for the asymmetric synthesis of pharmaceutical building blocks
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July 2017 |
1,4-NADH Biomimetic Co-Factors with Horse Liver Alcohol Dehydrogenase (HLADH), Utilizing [Cp*Rh(bpy)H](OTf) for Co-factor Regeneration, Do in Fact, Produce Chiral Alcohols from Reactions with Achiral Ketones
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June 2019 |
Noble−Metal Substitution in Hemoproteins: An Emerging Strategy for Abiological Catalysis
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January 2019 |
Biomimetic NAD+ Models for Tandem Cofactor Regeneration, Horse Liver Alcohol Dehydrogenase Recognition of 1,4-NADH Derivatives, and Chiral Synthesis
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January 2002 |
Unravelling the Reaction Mechanism of Formic Acid Dehydrogenation by Cp*Rh(III) and Cp*Co(III) Catalysts with Proton-Responsive 4,4′- and 6,6′-Dihydroxy-2,2′-Bipyridine Ligands: A DFT Study
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September 2019 |
Ab initio effective core potentials for molecular calculations. Potentials for K to Au including the outermost core orbitals
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January 1985 |
Regeneration of the NADH Cofactor by a Rhodium Complex Immobilized on Multi-Walled Carbon Nanotubes
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December 2014 |
A new ONIOM implementation in Gaussian98. Part I. The calculation of energies, gradients, vibrational frequencies and electric field derivatives
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April 1999 |
Self‐consistent molecular orbital methods. XX. A basis set for correlated wave functions
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January 1980 |
Stereospecific Biocatalytic Epoxidation: The First Example of Direct Regeneration of a FAD-Dependent Monooxygenase for Catalysis
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June 2003 |
Broadening the Scope of Biocatalysis in Sustainable Organic Synthesis
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April 2019 |
Analytical study of a series of substituted (2,2'-bipyridyl)(pentamethylcyclopentadienyl)rhodium and -iridium complexes with regard to their effectiveness as redox catalysts for the indirect electrochemical and chemical reduction of NAD(P)+
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May 1991 |
Efficient In Situ Regeneration of NADH Mimics by an Artificial Metalloenzyme
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May 2016 |
Directed Evolution: Bringing New Chemistry to Life
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November 2017 |
Continuous Generation of NADH from NAD⊕ and Formate Using a Homogeneous Catalyst with Enhanced Molecular Weight in a Membrane Reactor
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April 1990 |
Self‐consistent molecular orbital methods. XXIII. A polarization‐type basis set for second‐row elements
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October 1982 |
Cp* Noninnocence Leads to a Remarkably Weak C–H Bond via Metallocene Protonation
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February 2019 |
Biomimetic Oxidation Studies. 9. Mechanistic Aspects of the Oxidation of Alcohols with Functional, Active Site Methane Monooxygenase Enzyme Models in Aqueous Solution
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December 1995 |
Review of NAD(P)H-dependent oxidoreductases: Properties, engineering and application
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February 2018 |
Intermolecular interactions from a natural bond orbital, donor-acceptor viewpoint
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September 1988 |
Asymmetric Catalysis with an Inert Chiral-at-Metal Iridium Complex
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May 2013 |
Quantum Chemical and Molecular Docking Studies of [(η 6 -Cp*Rh-Tyr 1 )-Leu-enkephalin] 2+ to G-Protein-Coupled μ-, ∂-, and κ-Opioid Receptors and Comparisons to the Neuropeptide [Tyr 1 ]-Leu-enkephalin: Conformations, Noncovalent Amino Acid Binding Sites, Binding Energies, Electronic Factors, and Receptor Distortion Forces
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August 2015 |
Controlling Hydrogen Evolution during Photoreduction of CO 2 to Formic Acid Using [Rh(R-bpy)(Cp*)Cl] + Catalysts: A Structure–Activity Study
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May 2019 |
Density‐functional thermochemistry. III. The role of exact exchange
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April 1993 |
Directed evolution of cytochrome c for carbon–silicon bond formation: Bringing silicon to life
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November 2016 |
Artificial Metalloenzymes: Challenges and Opportunities
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July 2019 |
Recent developments and challenges of biocatalytic processes in the pharmaceutical industry
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June 2018 |
Recent trends and novel concepts in cofactor-dependent biotransformations
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December 2013 |
Role of Biocatalysis in Sustainable Chemistry
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September 2017 |
Inorganic Chemistry Approaches to Activity-Based Sensing: From Metal Sensors to Bioorthogonal Metal Chemistry
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June 2019 |
Bioorganometallic chemistry: biocatalytic oxidation reactions with biomimetic NAD+/NADH co-factors and [Cp*Rh(bpy)H]+ for selective organic synthesis
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December 2004 |
Computational Studies of the Mechanism for Proton and Hydride Transfer in Liver Alcohol Dehydrogenase
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May 2000 |
Catalytic Hydrogenation of Cytotoxic Aldehydes Using Nicotinamide Adenine Dinucleotide (NADH) in Cell Growth Media
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March 2016 |
Ab initio effective core potentials for molecular calculations. Potentials for the transition metal atoms Sc to Hg
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January 1985 |
The Chemoselective Reactions of Tyrosine-Containing G-Protein-Coupled Receptor Peptides with [Cp*Rh(H 2 O) 3 ](OTf) 2 , Including 2D NMR Structures and the Biological Consequences
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June 2012 |
Theoretical Studies on Reactions of Transition-Metal Complexes
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February 2000 |
Contracted Gaussian basis sets for molecular calculations. I. Second row atoms, Z=11–18
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May 1980 |
Engineering Cytochrome P450 Enzymes for Improved Activity towards Biomimetic 1,4-NADH Cofactors
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November 2008 |
Bioorganometallic Chemistry. 13. Regioselective Reduction of NAD + Models, 1-Benzylnicotinamde Triflate and β-Nicotinamide Ribose-5‘-methyl Phosphate, with in Situ Generated [Cp*Rh(Bpy)H] + : Structure−Activity Relationships, Kinetics, and Mechanistic Aspects in the Formation of the 1,4-NADH Derivatives †
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December 2001 |
Asymmetric transfer hydrogenation by synthetic catalysts in cancer cells
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January 2018 |
Optimization of parameters for semiempirical methods V: Modification of NDDO approximations and application to 70 elements
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September 2007 |
Enantioenriched Compounds via Enzyme-Catalyzed Redox Reactions
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July 2011 |
Alkane Oxidation: Methane Monooxygenases, Related Enzymes, and Their Biomimetics
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February 2017 |
Structural and Electrochemical Consequences of [Cp*] Ligand Protonation
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August 2017 |
Correlation between the Structure and Catalytic Activity of [Cp*Rh(Substituted Bipyridine)] Complexes for NADH Regeneration
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January 2017 |
Role of Ligand Protonation in Dihydrogen Evolution from a Pentamethylcyclopentadienyl Rhodium Catalyst
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September 2017 |
Ab initio effective core potentials for molecular calculations. Potentials for main group elements Na to Bi
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January 1985 |
An evaluation of the performance of diffuse function-augmented basis sets for second row elements, Na-Cl: Diffuse Function-Augmented Basis Sets
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December 1987 |
A model for catalytically active zinc(II) ion in liver alcohol dehydrogenase: a novel "hydride transfer" reaction catalyzed by zinc(II)-macrocyclic polyamine complexes
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December 1992 |
Zn Coordination Chemistry: Development of Benchmark Suites for Geometries, Dipole Moments, and Bond Dissociation Energies and Their Use To Test and Validate Density Functionals and Molecular Orbital Theory
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November 2007 |
Efficient diffuse function-augmented basis sets for anion calculations. III. The 3-21+G basis set for first-row elements, Li-F
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October 1983 |
Binding of Formamides to Liver Alcohol Dehydrogenase † , ‡
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March 1997 |
Unprecedented Alkene Complex of Zinc(II): Structures and Bonding of Divinylzinc Complexes
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March 2006 |
Energies, structures, and electronic properties of molecules in solution with the C-PCM solvation model
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April 2003 |