2013

Publikationer rss feed

2013
 

Discovery of a novel selective PPARγ ligand with partial agonist binding properties by integrated in silico / in vitro work flow

Kouskoumvekaki, Irene ; Petersen, Rasmus K. ; Fratev, Filip Filipov ; Taboureau, Olivier ; Nielsen, Thomas Eiland ; Oprea, Tudor ; Sonne, Si Brask ; Flindt, Esben N. ; Jonsdottir, Svava Osk ; Kristiansen, Karsten
in: Journal of Chemical Information and Modeling, vol: 53, issue: 4, pages: 923-937

Type: Journal article (Peer reviewed)

Status: Published     |    År: 2013     |    DOI: https://doi.org/10.1021/ci3006148

 

Distribution of MEG and methanol in well-defined hydrocarbon and water systems: Experimental measurement and modeling using the CPA EoS

Riaz, Muhammad ; Yussuf, Mustafe A. ; Kontogeorgis, Georgios ; Stenby, Erling Halfdan ; Yan, Wei ; Solbraa, Even
in: Fluid Phase Equilibria, vol: 337, pages: 298-310

Type: Journal article (Peer reviewed)

Status: Published     |    År: 2013     |    DOI: https://doi.org/10.1016/j.fluid.2012.09.009

  PDF

Does Pelletizing Catalysts Influence the Efficiency Number of Activity Measurements? Spectrochemical Engineering Considerations for an Accurate Operando Study

Rasmussen, Søren Birk ; Perez-Ferreras, Susana ; Banares, Miguel A. ; Bazin, Philippe ; Daturi, Marco
in: A C S Catalysis, vol: 3, issue: 1, pages: 86-94

Type: Journal article (Peer reviewed)

Status: Published     |    År: 2013     |    DOI: https://doi.org/10.1021/cs300687v

  PDF

Effects of mannose, fructose, and fucose on the structure, stability, and hydration of lysozyme in aqueous solution

Rahim, Abdoul ; Peters, Günther H.J. ; Jalkanen, Karl J. ; Westh, P
in: Current Physical Chemistry, vol: 3, issue: 1, pages: 113-125

Type: Journal article (Peer reviewed)

Status: Published     |    År: 2013

 

Efficient Isomerization of Glucose to Fructose over Zeolites in Consecutive Reactions in Alcohol and Aqueous Media.

Shunmugavel, Saravanamurugan ; Paniagua, Marta ; Melero, Juan A ; Riisager, Anders
in: Journal of the American Chemical Society, vol: 135, issue: 14, pages: 5246-5249

Type: Journal article (Peer reviewed)

Status: Published     |    År: 2013     |    DOI: https://doi.org/10.1021/ja400097f

 

Electrochemistry and in situ scanning tunnelling microscopy of pure and redox-marked DNA- and UNA-based oligonucleotides on Au(111)-electrode surfaces

Hansen, Allan Glargaard ; Salvatore, Princia ; Karlsen, K. ; Nichols, R. ; Wengel, Jesper ; Ulstrup, Jens
in: Physical Chemistry Chemical Physics, vol: 15, issue: 3, pages: 776-786

Type: Journal article (Peer reviewed)

Status: Published     |    År: 2013     |    DOI: https://doi.org/10.1039/c2cp42351k

 

Electrochemistry of Single Metalloprotein and DNA‐Based Molecules at Au(111) Electrode Surfaces

Salvatore, Princia ; Zeng, Dongdong ; Karlsen, Kasper Kannegård ; Chi, Qijin ; Wengel, Jesper ; Ulstrup, Jens
in: ChemPhysChem, vol: 14, issue: 10, pages: 2101-2111

Type: Journal article (Peer reviewed)

Status: Published     |    År: 2013     |    DOI: https://doi.org/10.1002/cphc.201300299

  PDF

Cis–Trans Amide Bond Rotamers in β-Peptoids and Peptoids: Evaluation of Stereoelectronic

Laursen, Jonas Striegler ; Engel-Andreasen, Jens ; Fristrup, Peter ; Harris, Pernille ; Olsen, Christian Adam
in: Journal of the American Chemical Society, vol: 135, issue: 7, pages: 2835-2844

Type: Journal article (Peer reviewed)

Status: Published     |    År: 2013     |    DOI: https://doi.org/10.1021/ja312532x

 

Epoxidation of Alkenes with Aqueous Hydrogen Peroxide and Quaternary Ammonium Bicarbonate Catalysts

Mielby, Jerrik Jørgen ; Kegnæs, Søren
in: Catalysis Letters, vol: 143, issue: 11, pages: 1162-1165

Type: Journal article (Peer reviewed)

Status: Published     |    År: 2013     |    DOI: https://doi.org/10.1007/s10562-013-1088-1

 

European Analytical Column

Andersen, Jens ; Buchberger, Wolfgang ; Worsfold, Paul
in: Trends in Analytical Chemistry, vol: 46, pages: XVI-XIX

Type: Journal article (Peer reviewed)

Status: Published     |    År: 2013

 

European Analytical Column No. 41

Andersen, Jens E. T. ; Buchberger, Wolfgang ; Worsfold, Paul
in: Analytical and Bioanalytical Chemistry, vol: 405, issue: 16, pages: 5361-5364

Type: Journal article (Peer reviewed)

Status: Published     |    År: 2013     |    DOI: https://doi.org/10.1007/s00216-013-6940-z

 

European Analytical Column No. 41

Andersen, Jens ; Buchberger, Wolfgang ; Worsfold, Paul
in: Serbian Chemical Society. Journal, vol: 78, issue: 4, pages: 603-609

Type: Journal article (Peer reviewed)

Status: Published     |    År: 2013

 

Exploring the conformational and reactive dynamics of biomolecules in solution using an extended version of the glycine reactive force field

Monti, Susanna ; Corozzi, Alessandro ; Fristrup, Peter ; Joshi, Kaushik L. ; Shin, Yun Kyung ; Oelschlaeger, Peter ; van Duin, Adri C. T. ; Barone, Vincenzo
in: Physical Chemistry Chemical Physics, vol: 15, issue: 36, pages: 15062-15077

Type: Journal article (Peer reviewed)

Status: Published     |    År: 2013     |    DOI: https://doi.org/10.1039/c3cp51931g

 

Extracellular DNA Shields against Aminoglycosides in Pseudomonas aeruginosa Biofilms

Chiang, Wen-Chi ; Nilsson, Martin ; Jensen, Peter Østrup ; Høiby, Niels ; Nielsen, Thomas Eiland ; Givskov, Michael ; Tolker-Nielsen, Tim
in: Antimicrobial Agents and Chemotherapy, vol: 57, issue: 5, pages: 202352-2361

Type: Journal article (Peer reviewed)

Status: Published     |    År: 2013     |    DOI: https://doi.org/10.1128/AAC.00001-13

  PDF

Field-free molecular orientation induced by single-cycle THz pulses: the role of resonance and quantum interference

Shu, Chuan-Cun ; Henriksen, Niels Engholm
in: Physical Review A, vol: 87, issue: 1, pages: Paper 013408

Type: Journal article (Peer reviewed)

Status: Published     |    År: 2013     |    DOI: https://doi.org/10.1103/PhysRevA.87.013408

 

Filming the Birth of Molecules and Accompanying Solvent Rearrangement

Lee, Jae Hyuk ; Wulff, Michael ; Bratos, Savo ; Petersen, Jakob ; Guerin, Laurent ; Leicknam, Jean-Claude ; Cammarata, Marco ; Kong, Qingyu ; Kim, Jeongho ; Møller, Klaus Braagaard ; Ihee, Hyotcherl
in: Journal of the American Chemical Society, vol: 135, pages: 3255−3261

Type: Journal article (Peer reviewed)

Status: Published     |    År: 2013     |    DOI: https://doi.org/10.1021/ja312513w

 

Formation of carboxy- and amide-terminated alkyl monolayers on silicon(111) investigated by ATR-FTIR, XPS, and X-ray scattering: Construction of photoswitchable surfaces

Rück-Braun, Karola ; Petersen, Michael Åxman ; Michalik, Fabian ; Hebert, Andreas ; Przyrembel, Daniel ; Weber, Christopher ; Ahmed, Saleh A. ; Kowarik, Stefan ; Weinelt, Martin
in: Langmuir, vol: 29, issue: 37, pages: 11758-11769

Type: Journal article (Peer reviewed)

Status: Published     |    År: 2013     |    DOI: https://doi.org/10.1021/la402068d

 

Frictional forces between hydrophilic and hydrophobic particle coated nanostructured surfaces

Hansson, Petra M ; Claesson, Per M. ; Swerin, Agne ; Briscoe, Wuge H ; Schoelkopf, Joachim ; Gane, Patrick A. C. ; Thormann, Esben
in: Physical Chemistry Chemical Physics, vol: 15, issue: 41, pages: 17893-17902

Type: Journal article (Peer reviewed)

Status: Published     |    År: 2013     |    DOI: https://doi.org/10.1039/c3cp52196f

 

Graphene Paper Doped with Chemically Compatible Prussian Blue Nanoparticles as Nanohybrid Electrocatalyst

Zhu, Nan ; Han, Shuang ; Gan, Shiyu ; Ulstrup, Jens ; Chi, Qijin
in: Advanced Functional Materials, vol: 23, issue: 42, pages: 5297-5306

Type: Journal article (Peer reviewed)

Status: Published     |    År: 2013     |    DOI: https://doi.org/10.1002/adfm.201300605

 

Heterometallic [AgFe3S4] ferredoxin variants: synthesis, characterization, and the first crystal structure of an engineered heterometallic iron–sulfur protein

Martic, Maja ; Simon, Ida Noemi ; Haahr, Lærke Tvedebrink ; Hagen, Wilfred Raymond ; Christensen, Hans Erik Mølager
in: Journal of Biological Inorganic Chemistry, vol: 18, issue: 2, pages: 261-276

Type: Journal article (Peer reviewed)

Status: Published     |    År: 2013     |    DOI: https://doi.org/10.1007/s00775-012-0971-3

 

High purity H2/H2O/Ni/SZ electrodes at 500º C

Høgh, Jens Valdemar Thorvald ; Hansen, Karin Vels ; Norrman, Kion ; Chorkendorff, Ib ; Jacobsen, Torben ; Mogensen, Mogens Bjerg
in: Solid State Ionics, vol: 234, pages: 11-18

Type: Journal article (Peer reviewed)

Status: Published     |    År: 2013     |    DOI: https://doi.org/10.1016/j.ssi.2012.12.015

 

High-resolution rovibrational analysis of CH281BrF in the range 920–980cm−1

Visinoni, R. ; Baldacci, A. ; Stoppa, P. ; Kollipost, F. ; Larsen, René Wugt
in: Chemical Physics Letters, vol: 579, pages: 16-22

Type: Journal article (Peer reviewed)

Status: Published     |    År: 2013     |    DOI: https://doi.org/10.1016/j.cplett.2013.06.002

 

Hyaluronan and phospholipid association in biolubrication

Wang, Min ; Liu, Chao ; Thormann, Esben ; Dedinaite, Andra
in: Biomacromolecules, vol: 14, issue: 12, pages: 4198-4206

Type: Journal article (Peer reviewed)

Status: Published     |    År: 2013     |    DOI: https://doi.org/10.1021/bm400947v

 

Hydrophobic Surfaces: Topography Effects on Wetting by Supercooled Water and Freezing Delay

Heydari, Golrokh ; Thormann, Esben ; Järn, Mikael ; Tyrode, Eric ; Claesson, Per
in: Journal of Physical Chemistry Part C: Nanomaterials and Interfaces, vol: 117, issue: 42, pages: 21752-21762

Type: Journal article (Peer reviewed)

Status: Published     |    År: 2013     |    DOI: https://doi.org/10.1021/jp404396m