Journal Article (223)
2013
Journal Article
Lababidi, S.; Panda, S. K.; ; Schrader, W. Direct Coupling of Normal-Phase High-Performance Liquid Chromatography to Atmospheric Pressure Laser Ionization Fourier Transform Ion Cyclotron Resonance Mass Spectrometry for the Characterization of Crude Oil. Analytical Chemistry 2013, 85, 9478–9485.
Journal Article
Liao, R.-Z.; Thiel, W. Convergence in the QM-only and QM/MM Modeling of Enzymatic Reactions: A Case Study for Acetylene Hydratase. Journal of Computational Chemistry 2013, 34, 2389–2397.
Journal Article
Breidung, J.; Goddard, R.; (Hexafluorosilicato-ƙ-2F,F')bis(1,10-Phenanthroline-ƙ2N,N')Zinc(II) Methanol Monosolvate. Acta Crystallographica, Section C: Crystal Structure Communications 2013, 69, 1112–1115.
; ;
Journal Article
Riplinger, C.; Sandhoefer, B.; Hansen, A.; Neese, F. Natural Triple Excitations in Local Coupled Cluster Calculations with Pair Natural Orbitals. The Journal of Chemical Physics 2013, 139, 134101.
Journal Article
Acevedo-Rocha, C. G.; ; ; Design of Protein Congeners Containing Beta-Cyclopropylalanine. Molecular BioSystems 2013, 8, 2719–2723.
Journal Article
Schmidt, W.; ; Catalytic Reduction of Nitrogen Oxides Via Nanoscopic Oxide Catalysts Within Activated Carbons at Room Temperature. Adsorption-Journal of the International Adsorption Society 2013, 19, 1027–1033.
;
Journal Article
Peng, B.; Geerdink, D.; Maulide, N. Electrophilic Rearrangements of Chiral Amides: A Traceless Asymmetric α-Allylation. Journal of the American Chemical Society 2013, 135, 14968–14971.
Journal Article
Peng, B.; Maulide, N. The Redox-Neutral Approach to C-H Functionalization. Chemistry-a European Journal 2013, 19, 13274–13287.
Journal Article
Ritter, T. Palladium(III)-Catalyzed Fluorination of Arylboronic Acid Derivatives. Journal of the American Chemical Society 2013, 135, 14012–14015.
; ; ; ;
Journal Article
Pérez Navarro, M.; Ames, W. M.; ; Lohmiller, T.; Pantazis, D. A.; Rapatskiy, L.; ; Neese, F.; ; ; Lubitz, W.; Cox, N. Ammonia Binding to the Oxygen-Evolving Complex of Photosystem II Identifies the Solvent-Exchangeable Oxygen Bridge (μ-Oxo) of the Manganese Tetramer. Proceedings of the National Academy of Sciences of the United States of America 2013, 110, 15561–15566.
Journal Article
Krämer, T.; Kampa, M.; Lubitz, W.; van Gastel, M.; Neese, F. Theoretical Spectroscopy of the NiII Intermediate States in the Catalytic Cycle and the Activation of [NiFe] Hydrogenases. ChemBioChem: A European Journal of Chemical Biology 2013, 14, 1898–1905.
Journal Article
Persich, P.; Llaveria, J.; Lhermet, R.; de Haro, T.; Stade, R.; Kondoh, A.; Fürstner, A. Increasing the Structural Span of Alkyne Metathesis. Chemistry – A European Journal 2013, 19, 13047–13058.
Journal Article
Barbatti, M. Theoretical Study on Excited-State Intermolecular Proton Transfer Reactions of 1H-Pyrrolo[3,2-h]Quinoline with Water and Methanol. Theoretical Chemistry Accounts 2013, 132, UNSP 1397.
; ; ; ;
Journal Article
Fürstner, A. Teaching Metathesis “Simple” Stereochemistry. Science 2013, 341, 1229713–1229711-12297137–12297137.
Journal Article
Bravo-Rodriguez, K.; ; ; ; ; Lehmann, C. W.; ; Sanchez-Garcia, E. Stereochemistry Rules: A Single Stereocenter Changes the Conformation of a Cyclic Tetrapeptide. The Journal of Physical Chemistry B 2013, 117, 10785–10791.
;
Journal Article
Marlow, F.; Sharifi, P.; Deng, T. S. Opal Shell Structures: Direct Assembly Versus Inversion Approach. Chemphyschem: a European journal of chemical physics and physical chemistry 2013, 14, 2893–2896.
Journal Article
Polyak, I.; Boulanger, E.; Sen, K.; Thiel, W. A Microiterative Intrinsic Reaction Coordinate Method for Large QM/MM Systems. Physical Chemistry Chemical Physics 2013, 15, 14188–14195.
Journal Article
Lee, J.-W.; ; ; ; ; List, B. Organotextile Catalysis. Science 2013, 341, 1225–1229.