Zobrazeno 1 - 10
of 116
pro vyhledávání: '"N Sears"'
Publikováno v:
International Journal of Athletic Therapy and Training. 26:20-25
Clinical Question: Do cultural-competence-based educational interventions improve the cultural competence of athletic training students, based on the constructs of the Campinha-Bacote model? Clinical Bottom Line: Athletic training programs can improv
Autor:
Pierre-Nicholas Roy, Hashem A. Taha, Norberto Castillo, Devin N. Sears, Todd L. Lowary, Roderick E. Wasylishen
Publikováno v:
Journal of chemical theory and computation. 6(1)
A molecular dynamics (MD) investigation on a series of oligo-α-arabinofuranosides (1-8) using the AMBER force field and the GLYCAM carbohydrate parameter set is reported. The validation of the method was carried out by direct comparison of experimen
Publikováno v:
Molecular Physics. 104:1217-1225
For the first time, the intermolecular hyperfine tensor at a 129Xe nucleus close to an O2 molecule has been calculated for various configurations. The quality of this quantum mechanical calculation has been tested against the experimentally measured
Autor:
Devin N. Sears, Bryan A. Demko, Roderick E. Wasylishen,† and, Kristopher J. Ooms, Yining Huang
Publikováno v:
Chemistry of Materials. 17:5481-5488
The formation of two aluminophosphate frameworks, AlPO4-5 and AlPO4-18, has been monitored using hyperpolarized 129Xe NMR as a probe. The reaction progress from an amorphous phase to AlPO4-5 and its subsequent conversion to AlPO4-18 is observed for x
Publikováno v:
The Journal of Chemical Physics. 121:9581-9592
The Xe nuclear magnetic resonance chemical shift differences that afford the discrimination between various biological environments are of current interest for biosensor applications and medical diagnostic purposes. In many such environments the Xe s
Publikováno v:
Journal of Peptide Science. 10:622-630
The synthetic octapeptide peptide T (ASTTTNYT) has been shown to interfere with binding of the HIV-1 envelope glycoprotein gp120 to the chemokine receptor R5, thus preventing viral infection. This study investigated the degree of conformational order
Autor:
Cynthia J. Jameson, Devin N. Sears
Publikováno v:
The Journal of Chemical Physics. 121:2151-2157
The 129Xe nuclear magnetic resonance spectrum of xenon in gas mixtures of Xe with other molecules provides a test of the ab initio surfaces for the intermolecular shielding of Xe in the presence of the other molecule. We examine the electron correlat
Publikováno v:
The Journal of Chemical Physics. 120:3277-3283
We investigate the odd and even character of the shielding response in a chiral molecule (modeled by a Ne8 helix) when subjected to a chiral potential. We establish that the diastereomeric splittings are a measure of odd powers of Vodd. Implications
Autor:
Devin N. Sears, Cynthia J. Jameson
Publikováno v:
The Journal of Chemical Physics. 119:12231-12244
Toward an understanding of the factors that affect the chemical shift in the Xe nuclear magnetic resonance spectrum of Xe atoms trapped in cages which may have applications as biosensors, we carry out calculations of Xe nuclear magnetic shielding usi
Publikováno v:
The Journal of Chemical Physics. 119:2685-2690
Chirality and, in particular, induced chirality is investigated using Xe interacting with chirally perturbed Ne helices. The full nuclear magnetic shielding tensors are calculated and physical implications are discussed.