1) Structural diversity of dimers of the Alzheimer amyloid-[small beta](25-35) peptide and polymorphism of the resulting fibrils (Physical Chemistry Chemical Physics) Thursday March 11th 2010 2) Investigations of the water clusters of the protected amino acid Ac-Phe-OMe by applying IR/UV double resonance spectroscopy: microsolvation of the backbone (Physical Chemistry Chemical Physics) Wednesday March 10th 2010 0 comments, related, 1 Up Vote 0 comments, related, 1 Up Vote 0 comments, related, 1 Up Vote 3) Importance of loop dynamics in the neocarzinostatin chromophore binding and release mechanisms (Physical Chemistry Chemical Physics) Wednesday March 10th 2010 4) A novel stabilisation model for ruthenium nanoparticles in imidazolium ionic liquids: in situ spectroscopic and labelling evidence (Physical Chemistry Chemical Physics) Wednesday March 10th 2010 5) A DFT study of PtAu bimetallic clusters adsorbed on MgO/Ag(100) ultrathin films (Physical Chemistry Chemical Physics) Wednesday March 10th 2010 0 comments, related, 1 Up Vote 0 comments, related, 1 Up Vote 0 comments, related, 1 Up Vote 6) Theoretical spectroscopy of floppy peptides at room temperature. A DFTMD perspective: gas and aqueous phase (Physical Chemistry Chemical Physics) Wednesday March 10th 2010 7) Direct measurement of vertical binding energy of a hydrated electron (Physical Chemistry Chemical Physics) Wednesday March 10th 2010 8) Two-component relativistic density functional theory modeling of the adsorption of element 114(eka-lead) on gold (Physical Chemistry Chemical Physics) Wednesday March 10th 2010 0 comments, related, 1 Up Vote 0 comments, related, 1 Up Vote 0 comments, related, 1 Up Vote 9) Molecular organization in self-assembled binary porphyrin nanotubes revealed by resonance Raman spectroscopy (Physical Chemistry Chemical Physics) Tuesday March 9th 2010 10) Linear viscoelasticity and thermorheological simplicity of n-hexadecane fluids under oscillatory shear via non-equilibrium molecular dynamics simulations (Physical Chemistry Chemical Physics) Tuesday March 9th 2010 11) Probing the specific interactions and structures of gas-phase vancomycin antibiotics with cell-wall precursor through IRMPD spectroscopy (Physical Chemistry Chemical Physics) Tuesday March 9th 2010 0 comments, related, 1 Up Vote 0 comments, related, 1 Up Vote 0 comments, related, 1 Up Vote 12) Two-dimensional network stability of nucleobases and amino acids on graphite under ambient conditions: adenine, l-serine and l-tyrosine (Physical Chemistry Chemical Physics) Tuesday March 9th 2010 13) Guanine-aspartic acid interactions probed with IR-UV resonance spectroscopy (Physical Chemistry Chemical Physics) Monday March 8th 2010 14) Binding a heparin derived disaccharide to defensin inspired peptides: insights to antimicrobial inhibition from gas-phase measurements (Physical Chemistry Chemical Physics) Saturday March 6th 2010 0 comments, related, 1 Up Vote 0 comments, related, 1 Up Vote 0 comments, related, 1 Up Vote 15) Supersonic jet UV spectrum and nonradiative processes of the thymine analogue 5-methyl-2-hydroxypyrimidine (Physical Chemistry Chemical Physics) Saturday March 6th 2010 16) Optical Kerr-effect study of trans- and cis-1,2-dichloroethene: liquid-liquid transition or super-Arrhenius relaxation (Physical Chemistry Chemical Physics) Friday March 5th 2010 17) Insulin dimer dissociation and unfolding revealed by amide I two-dimensional infrared spectroscopy (Physical Chemistry Chemical Physics) Friday March 5th 2010 0 comments, related, 1 Up Vote 0 comments, related, 1 Up Vote 0 comments, related, 1 Up Vote 18) Micron-sized [6,6]-phenyl C61 butyric acid methyl ester crystals grown by dip coating in solvent vapour atmosphere: interfaces for organic photovoltaics (Physical Chemistry Chemical Physics) Friday March 5th 2010 19) A fast redox-induced switching mechanism in a conformationally controllable molecular thread in solution (Physical Chemistry Chemical Physics) Friday March 5th 2010 20) Control of the average spacing between aligned gold nanoparticles by varying the FIB dose (Physical Chemistry Chemical Physics) Friday March 5th 2010 0 comments, related, 1 Up Vote 0 comments, related, 1 Up Vote 0 comments, related, 1 Up Vote 21) Nitrogen dioxide reactions with atomic lanthanide cations and their monoxides: gas-phase kinetics at room temperature (Physical Chemistry Chemical Physics) Friday March 5th 2010 22) Six conformers of neutral aspartic acid identified in the gas phase (Physical Chemistry Chemical Physics) Friday March 5th 2010 23) Self-assembled monolayers of benzylmercaptan and para-cyanobenzylmercaptan on gold: surface infrared spectroscopic characterization (Physical Chemistry Chemical Physics) Friday March 5th 2010 0 comments, related, 1 Up Vote 0 comments, related, 1 Up Vote 0 comments, related, 1 Up Vote 24) Towards understanding a mechanism for reversible hydrogen storage: theoretical study of transition metal catalysed dehydrogenation of sodium alanate (Physical Chemistry Chemical Physics) Thursday March 4th 2010 25) Charge carrier dynamics in thiol capped CdTe quantum dots (Physical Chemistry Chemical Physics) Thursday March 4th 2010 26) Structural characterization of self-assembled monolayers of pyridine-terminated thiolates on gold (Physical Chemistry Chemical Physics) Thursday March 4th 2010 0 comments, related, 1 Up Vote 0 comments, related, 1 Up Vote 0 comments, related, 1 Up Vote 27) Results and perspectives of the MO-VB method. Application examples on the He2 and the LiH-He complexes (Physical Chemistry Chemical Physics) Thursday March 4th 2010 28) Infrared vibrational spectra as a structural probe of gaseous ions formed by caffeine and theophylline (Physical Chemistry Chemical Physics) Thursday March 4th 2010 29) Quantification of the adhesion strength of fibroblast cells on ethylene glycol terminated self-assembled monolayers by a microfluidic shear force assay (Physical Chemistry Chemical Physics) Wednesday March 3rd 2010 0 comments, related, 1 Up Vote 0 comments, related, 1 Up Vote 0 comments, related, 1 Up Vote 30) FRET and ligand related NON-FRET processes in single quantum dot-perylene bisimide assemblies (Physical Chemistry Chemical Physics) Wednesday March 3rd 2010 31) Growth of solid conical structures during multistage drying of sessile poly(ethylene oxide) droplets (Physical Chemistry Chemical Physics) Wednesday March 3rd 2010 32) [Ni(tmen)(acac)][B(Ph)4] a probe for the anion basicity of ionic liquids (Physical Chemistry Chemical Physics) Wednesday March 3rd 2010 0 comments, related, 1 Up Vote 0 comments, related, 1 Up Vote 0 comments, related, 1 Up Vote 33) Volumetric properties of human islet amyloid polypeptide in liquid water (Physical Chemistry Chemical Physics) Wednesday March 3rd 2010 34) Application of high level wavefunction methods in quantum mechanics/molecular mechanics hybrid schemes (Physical Chemistry Chemical Physics) Tuesday March 2nd 2010 35) Iron phthalocyanine in non-aqueous medium forming layer-by-layer films: growth mechanism, molecular architecture and applications (Physical Chemistry Chemical Physics) Tuesday March 2nd 2010 0 comments, related, 1 Up Vote 0 comments, related, 1 Up Vote 0 comments, related, 1 Up Vote 36) Photoionization of 2-pyridone and 2-hydroxypyridine (Physical Chemistry Chemical Physics) Tuesday March 2nd 2010 37) Guided ion beam and theoretical studies of the reaction of Ru+ with CS2 in the gas-phase: thermochemistry of RuC+, RuS+, and RuCS+ (Physical Chemistry Chemical Physics) Monday March 1st 2010 38) Mechanistical studies on the formation and destruction of carbon monoxide (CO), carbon dioxide (CO2), and carbon trioxide (CO3) in interstellar ice analog samples (Physical Chemistry Chemical Physics) Monday March 1st 2010 0 comments, related, 1 Up Vote 0 comments, related, 1 Up Vote 0 comments, related, 1 Up Vote 39) Role of excited-state hydrogen detachment and hydrogen-transfer processes for the excited-state deactivation of an aromatic dipeptide: N-acetyl tryptophan methyl amide (Physical Chemistry Chemical Physics) Monday March 1st 2010 40) Dynamics of heparan sulfate explored by neutron scattering (Physical Chemistry Chemical Physics) Monday March 1st 2010 41) Electronic coupling between cytosine bases in DNA single strands and i-motifs revealed from synchrotron radiation circular dichroism experiments (Physical Chemistry Chemical Physics) Saturday February 27th 2010 0 comments, related, 1 Up Vote 0 comments, related, 1 Up Vote 0 comments, related, 1 Up Vote 42) Hydration of nucleic acid bases: a Car-Parrinello molecular dynamics approach (Physical Chemistry Chemical Physics) Saturday February 27th 2010 43) Cycle formation from acetylene addition on C4H3 radicals (Physical Chemistry Chemical Physics) Friday February 26th 2010 44) Jet-cooled spectroscopy of paracetamol (Physical Chemistry Chemical Physics) Friday February 26th 2010 0 comments, related, 1 Up Vote 0 comments, related, 1 Up Vote 0 comments, related, 1 Up Vote 45) Controlling particle morphology and size in the synthesis of mesoporous SBA-15 materials (Physical Chemistry Chemical Physics) Friday February 26th 2010 46) Theoretical study on conformational preferences of ribose in 2-thiouridine-the role of the 2[prime or minute]OH group (Physical Chemistry Chemical Physics) Friday February 26th 2010 47) Monitoring electronic structure changes of TiO2(110) via sign reversal of adsorbate vibrational bands (Physical Chemistry Chemical Physics) Friday February 26th 2010 0 comments, related, 1 Up Vote 0 comments, related, 1 Up Vote 0 comments, related, 1 Up Vote 48) Structural, energetic and dynamical properties of sodiated oligoglycines: relevance of a polarizable force field (Physical Chemistry Chemical Physics) Friday February 26th 2010 49) Freezing, melting and structure of ice in a hydrophilic nanopore (Physical Chemistry Chemical Physics) Friday February 26th 2010 50) Tuning the local frictional and electrostatic responses of nanostructured SrTiO3-surfaces by self-assembled molecular monolayers (Physical Chemistry Chemical Physics) Thursday February 25th 2010 0 comments, related, 1 Up Vote 0 comments, related, 1 Up Vote 0 comments, related, 1 Up Vote View: prev | next

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