Scientific Publications
Journal Article (200)
1.
Journal Article
82 (12), pp. 1396 - 1407 (2017)
Electronic Structure Calculations and Experimental Studies on the Thermal Initiation of the Twin Polymerization Process. ChemPlusChem 2.
Journal Article
147 (23), 234109 (2017)
A dynamic correlation dressed complete active space method: Theory, implementation, and preliminary applications. The Journal of Chemical Physics 3.
Journal Article
82 (24), pp. 13563 - 13571 (2017)
Computational Insights into an Enzyme-Catalyzed [4+2] Cycloaddition. Journal of Organic Chemistry 4.
Journal Article
46 (46), pp. 16216 - 16227 (2017)
Dicationic phosphonium salts: Lewis acid initiators for the Mukaiyama-aldol reaction. Dalton Transactions 5.
Journal Article
139 (49), pp. 17890 - 17901 (2017)
Spatially Heterogeneous Surface Water Diffusivity around Structured Protein Surfaces at Equilibrium. Journal of the American Chemical Society 6.
Journal Article
19 (45), pp. 30316 - 30331 (2017)
Solvent water interactions within the active site of the membrane type I matrix metalloproteinase. Physical Chemistry Chemical Physics 7.
Journal Article
7 (23), pp. 5614 - 5624 (2017)
Selective glycerol oxidation over ordered mesoporous copper aluminum oxide catalysts. Catalysis Science & Technology 8.
Journal Article
56 (49), pp. 15693 - 15697 (2017)
Nickel-Catalyzed Cyanation of Aryl Chlorides and Triflates Using Butyronitrile: Merging Retro-hydrocyanation with Cross-Coupling. Angewandte Chemie International Edition 9.
Journal Article
89 (12), pp. 1686 - 1693 (2017)
IR Microimaging of Direction‐Dependent Uptake in MFI‐Type Crystals. Chemie-Ingenieur-Technik 10.
Journal Article
47 (6), pp. 187 - 197 (2017)
Face-to-Face Stacking and Saddle Distortion of 5,10,15,20-Tetra(4- hydroxyphenyl)porphyrinatocopper(II) in Two New Solvates. Journal of Chemical Crystallography 11.
Journal Article
28 (18), pp. 2425 - 2428 (2017)
Ether Synthesis through Reductive Cross-Coupling of Ketones with Alcohols Using Me2SiHCl as both Reductant and Lewis Acid. Synlett 12.
Journal Article
548, pp. 52 - 61 (2017)
The roles of Co-precipitation pH, phase-purity and alloy formation for the ammonia decomposition activity of Ga-promoted Fe/MgO catalysts. Applied Catalysis A: General 13.
Journal Article
9 (22), pp. 4238 - 4243 (2017)
Monodispersed Mesoporous Silica Spheres Supported Co3O4 as Robust Catalyst for Oxygen Evolution Reaction. ChemCatChem 14.
Journal Article
50 (11), pp. 2822 - 2833 (2017)
Facile C−F Bond Formation through a Concerted Nucleophilic Aromatic Substitution Mediated by the PhenoFluor Reagent. Accounts of Chemical Research 15.
Journal Article
82 (22), pp. 11669 - 11681 (2017)
Synthesis of Benzoxazoles Using Electrochemically Generated Hypervalent Iodine. The Journal of Organic Chemistry 16.
Journal Article
139 (45), pp. 16256 - 16263 (2017)
The Molecular Tweezer CLR01 Stabilizes a Disordered Protein–Protein Interface. Journal of the American Chemical Society 17.
Journal Article
147 (18), 184109 (2017)
Surface hopping dynamics including intersystem crossing using the algebraic diagrammatic construction method. The Journal of Chemical Physics 18.
Journal Article
28 (18), pp. 2435 - 2438 (2017)
Design and Synthesis of Enantiopure Tetrakis(pentafluorophenyl) Borate Analogues for Asymmetric Counteranion Directed Catalysis. Synlett 19.
Journal Article
56 (46), pp. 14763 - 14769 (2017)
Fully Automated Quantum‐Chemistry‐Based Computation of Spin–Spin‐Coupled Nuclear Magnetic Resonance Spectra. Angewandte Chemie International Edition 20.
Journal Article
15 (46), pp. 9824 - 9829 (2017)
Manipulating the stereoselectivity of the thermostable Baeyer–Villiger monooxygenase TmCHMO by directed evolution. Organic & Biomolecular Chemistry