| Title |
Published |
SHARCNET Authors |
Area |
|
541.
Molecular mechanics and all-electron fragment molecular orbital calculations on mutated polyglutamine peptides
|
2010 |
B.M.B. Van Schouwen, M. Nakano, H. Watanabe, S. Tanaka, H.L. Gordon, and S.M. Rothstein
|
Computational And Theoretical Chemistry
|
|
542.
a2 Ion Derived from Triglycine: An N1-Protonated 4-Imidazolidinone
|
2010 |
Udo H. Verkerk, Chi-Kit Siu, Jeffrey D. Steill, Houssain El Aribi, Junfang Zhao, Christopher F. Rodriquez, Jos Oomens, Alan C. Hopkinson and K. W. Michael Siu
|
Computational Chemistry
|
|
543.
Optimization of Parameters Used in Algorithms of Ion-Mobility Calculation for Conformational Analyses
|
2010 |
Chi-Kit Siu, Yuzhu Guo, Irine S. Saminathan, Alan C. Hopkinson, K. W. Michael Siu
|
Computational Chemistry
|
|
544.
Verdazyl radicals as redox-active, non-innocent, ligands: contrasting electronic structures as a function of electron-poor and electron-rich ruthenium bis(beta-diketonate) co-ligands
|
2010 |
Stephen D.J. McKinnon, Brian O. Patrick, A. B. P. Lever* and Robin G. Hicks*
|
Inorganic Chemistry
|
|
545.
Electronic Characteristics of an Extensive Series of Ruthenium Complexes with the Non-Innocent o-Benzoquinonediimine Ligand; A Pedagogical Approach
|
2010 |
A B P Lever
|
Inorganic Chemistry
|
|
546.
Job Search, Bargaining, and Wage Dynamics
|
2010 |
Shintaro Yamaguchi
|
Economics
|
|
547.
A homology model of the pore domain of a voltage-gated calcium channel is consistent with available SCAM data
|
2010 |
Bruhova I, Zhorov BS
|
Biophysics
|
|
548.
Gas phase isomerization enthalpies of organic compounds: A semiempirical, density functional theory, and ab initio post-Hartree-Fock theoretical study
|
2010 |
S Rayne, K Forest
|
Environmental Modelling and Analysis
|
|
549.
An efficient string sorting algorithm for weighing matrices of small weight
|
2010 |
I. S. Kotsireas, C. Koukouvinos, P. M. Pardalos
|
Computer Algebra
|
|
550.
Accounting for the Rise in Consumer Bankruptcies
|
2010 |
Igor Livshits, James MacGee, Michele Tertilt
|
Computational Macroeconomics
|
|
551.
Computational Note on a G4MP2 study into the gas phase enthalpies of formation and isomerization for the (CH)2n (n=1 to 6) isomers
|
2010 |
S Rayne, K Forest
|
Environmental Modelling and Analysis
|
|
552.
Hadamard matrices of small order and Yang conjecture
|
2010 |
D.Z. Djokovic
|
Hadamard Matrices
|
|
553.
âSpectrally-Accurate Algorithm for Moving Boundary Problems for the Navier-Stokes Equationsâ
|
2010 |
S.Z.Husain and J.M.Floryan
|
Fluid Mechanics
|
|
554.
âTravelling Wave Instability in a Diverging-Converging Channelâ
|
2010 |
J.M.Floryan and C.Floryan
|
Fluid Mechanics
|
|
555.
Job Allocation Strategies for Multiple High Performance Computing Clusters
|
2010 |
J. Qin and M. Bauer
|
Distributed Systems
|
|
556.
Docking flexible ligands in proteins with a solvent exposure- and distance-dependent dielectric function
|
2010 |
DP Garden and BS Zhorov
|
Biophysics
|
|
557.
Structural modeling of calcium binding in the selectivity filter of the L-type calcium channel
|
2010 |
Cheng RC, Tikhonov DB, Zhorov BS
|
Biophysics
|
|
558.
Simultaneous Use of Temperature and Concentration Gradients to Control Polymer Solution Morphology Development during Thermal-Induced Phase Separation
|
2010 |
S. Hong and P.K. Chan
|
Soft Matter Physics
|
|
559.
Compression-Induced Transformation of Aldehydes into Polyethers: A First-Principles Molecular Dynamics Study
|
2010 |
N.J. Mosey
|
Computational Chemistry
|
|
560.
Docking of calcium ions in proteins with flexible side chains and deformable backbones
|
2010 |
Cheng RC, Zhorov BS.
|
Biophysics
|
