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Publications by SHARCNET researchers

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Title Published SHARCNET Authors Area
141. Theoretical studies in the molecular Platonic solids: Pure and mixed carbon, nitrogen, phosphorus, and silicon tetrahedranes 2011 S Rayne, K Forest Computational Physical Organic Chemistry For The Energy And Environmental Sciences
142. Closure of non-equilibrium volume-averaged energy equations in high-conductivity porous media 2011 C.T. DeGroot, A.G. Straatman
143. Batrachotoxin, Pyrethroids, and BTG 502 Share Overlapping Binding Sites on Insect Sodium Channels 2011 Du Y, Garden D, Khambay B, Zhorov BS, Dong K Biomolecular Simulations
144. Silica through the eyes of colloidal models – when glass is a gel 2011 I. Saika-Voivod, H.M. King, P. Tartaglia, F. Sciortino, and E. Zaccarelli Liquids And Soft Matter
145. Molecular dynamics modeling of tubulin C-terminal tail interactions with the microtubule surface 2011 Freedman, H.; Luchko, T.; Luduena, R. F.; Tuszynski, J. A. Computational Biology
146. Relaxed complex scheme suggests novel inhibitors for the lyase activity of DNA polymerase beta 2011 Khaled Barakat and Jack Tuszynski Computational Biology
147. Entropic fragment based approach to aptamer design 2011 Tseng, C.-Y., Ashrafuzzaman, M, Mane, J. Y., Kapty, J., Mercer, J. R. and Tuszynski, J. A. Computational Biology
148. Quantitative assessment of upstream source influences on total gaseous mercury observations in Ontario, Canada 2011 D. Wen, J.C. Lin, F. Meng, P.K. Gbor, Z. He, J.J. Sloan Atmopheric Science
149. Attributing uncertainties in simulated biospheric carbon fluxes to different sources of error 2011 J.C. Lin, M.R. Pejam, E. Chan, S.C. Wofsy, E.W. Gottlieb, H.A. Margolis, J.H. McCaughey Atmopheric Science
150. Studying atmospheric transport through Lagrangian models 2011 J.C. Lin, D. Brunner, C. Gerbig Atmopheric Science
151. Higher order expansion of Keldysh integral for hydrogen atom and H2+ molecular ion 2011 Z. J. Long, W.-K. Liu Chemical Physics
152. Finding small backdoors in SAT instances 2011 Z. Li, P. van Beek Artificial Intelligence
153. A comparison of density functional theory (DFT) methods for estimating the singlet-triplet (S0-T1) excitation energies of benzene and polyacenes 2011 S Rayne, K Forest Computational Physical Organic Chemistry For The Energy And Environmental Sciences
154. Survey of main group compounds (H-Br) at the Gaussian-4 level of theory: Adiabatic ionization energies and enthalpies of formation 2011 S Rayne, K Forest Computational Physical Organic Chemistry For The Energy And Environmental Sciences
155. A G4MP2 and G4 theoretical study into the thermochemical properties of explosophore substituted tetrahedranes and cubanes 2011 S Rayne, K Forest Computational Physical Organic Chemistry For The Energy And Environmental Sciences
156. Response Curves and Preimage Sequences of Two-Dimensional Cellular Automata 2011 H. Fukś and A. Skelton Cellular Automata, Discrete Dynamical Systems
157. Glutathione Radical Cation in the Gas Phase; Generation, Structure and Fragmentation 2011 Junfang Zhao, K. W. Michael Siu and Alan C. Hopkinson Mass Spectrometry
158. Pore scale modeling of a proton exchange membrane fuel cell catalyst layer: Effects of water vapor and temperature 2011 118. Lange K. J., P.C. Sui, and N. Djilali Computational Fluid Dynamics, Energy Systems, Fuel Cells
159. A numerical study on preconditioning and partitioning schemes for reactive transport in a PEMFC catalyst layer 2011 121. Lange K.J.; C. Misra, P.C. Sui, and N. Djilali Computational Fluid Dynamics, Energy Systems, Fuel Cells
160. Spin-wave damping in ferromagnetic stripes with inhomogeneous magnetization 2011 Hoa Nguyen, A. Akbari-Sharbaf, M. G. Cottam Condensed Matter Theory And Statistical Mechanics