Journal Article (197)

2018
Journal Article
Knossalla, J.; Paciok, P.; Göhl, D.; Jalalpoor, D.; Pizzutilo, E.; Mingers, A. M.; Heggen, M.; Dunin-Borkowski, R. E.; Mayrhofer, K. J. J.; Schüth, F.; Ledendecker, M. Shape-Controlled Nanoparticles in Pore-Confined Space. Journal of the American Chemical Society 2018, 140, 15684–15689.
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Gomes, F.; Echeverria, P.-G.; Fürstner, A. Iron- or Palladium-Catalyzed Reaction Cascades Merging Cycloisomerization and Cross-Coupling Chemistry. Chemistry – A European Journal 2018, 24, 16814–16822.
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Tuna, D.; Spörkel, L.; Barbatti, M.; Thiel, W. Nonadiabatic Dynamics Simulations of Photoexcited Urocanic Acid. Chemical Physics 2018, 515, 521–534.
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Cadet, F.; Fontaine, N.; Li, G.; Sanchis, J.; Chong, M. N. F.; Pandjaitan, R.; Vetrivel, I.; Offmann, B.; Reetz, M. T. A Machine Learning Approach for Reliable Prediction of Amino Acid Interactions and its Application in the Directed Evolution of Enantioselective Enzymes. Scientific Reports 2018, 8, 16757.
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Rottschäfer, D.; Busch, J.; Neumann, B.; Stammler, H.-G.; van Gastel, M.; Kishi, R.; Nakano, M.; Ghadwal, R. S. Diradical Character Enhancement by Spacing: N-Heterocyclic Carbene Analogues of Müller's Hydrocarbon. Chemistry – A European Journal 2018, 24, 16537–16542.
Journal Article
Ripka, B.; Eills, J.; Kouřilová, H.; Leutzsch, M.; Levitt, M. H.; Münnemann, K. Hyperpolarized Fumarate Via Parahydrogen. Chemical Communications 2018, 54, 12246–12249.
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Xiao, P.; Li, C.-X.; Fang, W.-H.; Cui, G.; Thiel, W. Mechanism of the Visible-Light-Mediated Copper-Catalyzed Coupling Reaction of Phenols and Alkynes. Journal of the American Chemical Society 2018, 140, 15099–15113.
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Ruiz-Fuertes, J.; Martínez-García, D.; Marqueño, T.; Errandonea, D.; MacLeod, S. G.; Bernert, T.; Haussühl, E.; Santamaría-Pérez, D.; Ibáñez, J.; Mallavarapu, A.; Achary, S. N.; Popescu, C.; Bettinelli, M. High-Pressure High-Temperature Stability and Thermal Equation of State of Zircon-Type Erbium Vanadate. Inorganic Chemistry 2018, 57, 14005–14012.
Journal Article
Schulz, C. E.; Dutta, A. K.; Izsák, R.; Pantazis, D. A. Systematic High-Accuracy Prediction of Electron Affinities for Biological Quinones. Journal of Computational Chemistry 2018, 39, 2439–2451.
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Khire, S. S.; Sahu, N.; Gadre, S. R. Harnessing Desktop Computers for Ab Initio Calculation of Vibrational IR/Raman Spectra of Large Molecules. Journal of Chemical Sciences 2018, 130, 159.
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Tinnermann, H.; Nicholls, L. D. M.; Johannsen, T.; Wille, C.; Golz, C.; Goddard, R.; Alcarazo, M. N‑Arylpyridiniophosphines: Synthesis, Structure, and Applications in Au(I) Catalysis. ACS Catalysis 2018, 8, 10457–10463.
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Legnani, L.; Prina Cerai, G.; Delcaillau, T.; Willems, S.; Morandi, B. Efficient Access to Unprotected Primary Amines by Iron-Catalyzed Aminochlorination of Alkenes. Science 2018, 362, 434–438.
Journal Article
Nattmann, L.; Lutz, S.; Ortsack, P.; Goddard, R.; Cornella, J. A Highly Reduced Ni–Li–Olefin Complex for Catalytic Kumada–Corriu Cross-Couplings. Journal of the American Chemical Society 2018, 140, 13628–13633.
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Shevchenko, G. A.; Dehn, S.; List, B. Brønsted Acid Mediated Direct α-Hydroxylation of Cyclic α-Branched Ketones. Synlett 2018, 29, 2298–2300.
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Rickmeier, J.; Ritter, T. Site‐Specific Deoxyfluorination of Small Peptides with [18F]Fluoride. Angewandte Chemie International Edition 2018, 57, 14207–14211.
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Grünert, A.; Losch, P.; Ochoa-Hernandez, C.; Schmidt, W.; Schüth, F. Gas-Phase Synthesis of Oxymethylene Ethers over Si-Rich Zeolites. Green Chemistry 2018, 20, 4719–4728.
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König, G.; Pickard, F. C.; Huang, J.; Thiel, W.; MacKerell, A. D.; Brooks, B. R.; York, D. M. A Comparison of QM/MM Simulations with and Without the Drude Oscillator Model Based on Hydration Free Energies of Simple Solutes. Molecules 2018, 23, 2695.
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Himmelberg, A. M.; Brüls, T.; Farmani, Z.; Weyrauch, P.; Barthel, G.; Schrader, W.; Meckenstock, R. U. Anaerobic Degradation of Phenanthrene by a Sulfate‐Reducing Enrichment Culture. Environmental Microbiology 2018, 20, 3589–3600.
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O'Neill, M.; Cornella, J. Retaining Alkyl Nucleophile Regiofidelity in Transition-Metal- Mediated Cross-Couplings to Aryl Electrophiles. Synthesis 2018, 50, 3974–3996.
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Santos, J. M.; Vetere, A.; Wisniewski Jr., A.; Eberlin, M. N.; Schrader, W. Comparing Crude Oils with Different API Gravities on a Molecular Level Using Mass Spectrometric Analysis. Part 2: Resins and Asphaltenes. Energies 2018, 11, 2767.
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