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Proceedings of the National Academy of Sciences of the United States of America, ISSN 0027-8424, 2/2004, Volume 101, Issue 5, pp. 1195 - 1199
Journal Article
The Journal of Physical Chemistry C, ISSN 1932-7447, 01/2016, Volume 120, Issue 2, pp. 934 - 943
The interactions of two model dipolar molecules (acetonitrile (ACN) and methanol (MeOH)) with amorphous solid water (ASW) were investigated using... 
MOLECULAR-DYNAMICS | H2O | MATERIALS SCIENCE, MULTIDISCIPLINARY | CHEMISTRY, PHYSICAL | NANOSCIENCE & NANOTECHNOLOGY | ELECTRON SPECTROSCOPIES | GLASS-LIQUID TRANSITION | ICE SURFACES | PREFERENTIAL SOLVATION | MIXTURES | FILMS | TEMPERATURE | CLATHRATE HYDRATE
Journal Article
Physical chemistry chemical physics : PCCP, ISSN 1463-9076, 03/2017, Volume 19, Issue 9, pp. 6345 - 6357
We performed all-atom MD simulations of the protein SNase in aqueous solution and in the presence of two major osmolytes, trimethylamine-N-oxide (TMAO) and... 
Journal Article
Physical Chemistry Chemical Physics, ISSN 1463-9076, 3/2017, Volume 19, Issue 9, pp. 6345 - 6357
We performed all-atom MD simulations of the protein SNase in aqueous solution and in the presence of two major osmolytes, trimethylamine- N -oxide (TMAO) and... 
PREFERENTIAL INTERACTIONS | TRIMETHYLAMINE-N-OXIDE | MOLECULAR-DYNAMICS | STABILIZING OSMOLYTES | VOLUMETRIC PROPERTIES | HYDROPHOBIC HYDRATION | PHYSICS, ATOMIC, MOLECULAR & CHEMICAL | CHEMISTRY, PHYSICAL | FORCE-FIELD | PARTICLE MESH EWALD | VIBRATIONAL SPECTROSCOPY | WATER-STRUCTURE | Proteins | Solvents | Hydration | Volume fraction | Ureas | Hydrophobicity | Signatures | Contact
Journal Article
Journal of the American Chemical Society, ISSN 0002-7863, 03/2014, Volume 136, Issue 10, pp. 4040 - 4047
We applied ultrasonic velocimetric and high-precision densimetric measurements to characterizing the helix-to-coil transition of the GGCATTACGG/CCGTAATGCC... 
PREFERENTIAL INTERACTION | AQUEOUS-SOLUTIONS | EQUILIBRIUM MELTING CURVES | PARTIAL MOLAR VOLUMES | HEAT-CAPACITY CHANGES | EXTRACTING THERMODYNAMIC DATA | SCALED-PARTICLE THEORY | ORDER-DISORDER TRANSITIONS | CHEMISTRY, MULTIDISCIPLINARY | OSMOTIC-STRESS EXPERIMENTS | NUCLEIC-ACIDS
Journal Article
Journal of the American Chemical Society, ISSN 0002-7863, 02/2005, Volume 127, Issue 7, pp. 2184 - 2190
Journal Article
Applied Surface Science, ISSN 0169-4332, 05/2019, Volume 476, pp. 6 - 15
The surface hydration is one of the main reasons for the difficulty of coal slurry water sedimentation and dewatering, the Density functional theory (DFT) and... 
Water | Molecular dynamics | Surface hydration | Density functional theory | Kaolinite | PHYSICS, CONDENSED MATTER | CLAY-MINERALS | PHYSICS, APPLIED | FLOTATION | PARTICLES | BEHAVIOR | COAL | CHEMISTRY, PHYSICAL | COPPER | ADSORPTION | ACCURACY | NMR | MATERIALS SCIENCE, COATINGS & FILMS | Density functionals | Adsorption | Hydrogen | Hydrogen bonding
Journal Article
Biophysical Journal, ISSN 0006-3495, 07/2018, Volume 115, Issue 2, pp. 313 - 327
The mechanisms of protein stabilization by uncharged solutes, such as polyols and sugars, have been intensively studied with respect to the chemical... 
AMYLOID FIBRILS | APOMYOGLOBIN | BIOPHYSICS | MYOGLOBIN | STABILITY | NEUTRON-SCATTERING | DYNAMICS | X-RAY-SCATTERING | PREFERENTIAL INTERACTION COEFFICIENTS | SOLVATION | WATER | Myoglobin | Glycerin | Oligomers | Glycerol | Analysis | Proteins
Journal Article
ChemPhysChem, ISSN 1439-4235, 04/2017, Volume 18, Issue 7, pp. 864 - 864
The Back Cover picture summarizes the change in the collective hydration dynamics of a protein in water–alcohol binary mixtures. More information can be found... 
time-domain spectroscopy | circular dichroism | preferential binding | absorption | hydration
Journal Article
Journal Article
The Journal of Physical Chemistry B, ISSN 1520-6106, 04/2017, Volume 121, Issue 13, pp. 2748 - 2758
The ETS family of transcription factors is a functionally heterogeneous group of gene regulators that share a structurally conserved, eponymous DNA-binding... 
PREFERENTIAL INTERACTIONS | BINDING DOMAINS | COMPLEX | OSMOTIC-STRESS | INHIBITION | FACTOR PU.1 | DISCRIMINATION | DYNAMICS | CHEMISTRY, PHYSICAL | EXPRESSION | MODULATION | DNA - chemistry | Proto-Oncogene Proteins c-ets - chemistry | Humans | Molecular Dynamics Simulation | Water - chemistry | Molecular simulation | Usage | Research | DNA binding proteins | Genetic regulation | Osmotic pressure
Journal Article
ChemPhysChem, ISSN 1439-4235, 04/2017, Volume 18, Issue 7, pp. 749 - 754
Journal Article