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Publications by SHARCNET researchers in 2010

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Title Published SHARCNET Authors Area
1. The 9-barbaralyl and related C9H9+ carbocations — A QTAIM-DI-VISAB computational study 2010 Nick H. Werstiuk Organic Chemistry
2. Constitutive relations in dense granular flows 2010 J.J. Drozd, C. Denniston Soft Condensed Matter Physics
3. Reactivity studies of N-heterocyclic carbene complexes of germanium(II) 2010 P. A. Rupar, V. N. Staroverov, and K. M. Baines Quantum Chemistry
4. An experimental and computational investigation of the formation and the structures of the N-hydro and N,N'-dihydro-benzo-2,1,3-chalcogenadiazolium chlorides 2010 L. M. Lee, P. J. W. Elder, A. F. Cozzolino, Q. Yang, I. Vargas-Baca Organometallic Chemistry, Inorganic Chemistry
5. Structure and Formation of the First (-O-Te-N-)4 Ring 2010 J. Kübel, P. J. W. Elder, H. A. Jenkins, I. Vargas-Baca Organometallic Chemistry, Inorganic Chemistry
6. Supramolecular chromotropism of the crystalline phases of 4,5,6,7-tetrafluorobenzo-2,1,3-telluradiazole 2010 A. F. Cozzolino P. S. Whitfield, I. Vargas-Baca Organometallic Chemistry, Inorganic Chemistry
7. Tracking the Flow of Water through Photosystem II Using Molecular Dynamics and Streamline Tracing 2010 Vassiliev,S.; Comte,P.; Mahboob,A.; Bruce,D. Photosynthesis
8. Effect of Selective Accommodation on Soot Aggregate Shielding in Time-Resolved Laser-Induced Incandescence Experiments 2010 K. J. Daim Combustion Diagnostics
9. Lemieux Award Lecture 2008. Rate constants for decarboxylation reactions calculated using no barrier theory. 2010 Guthrie, J. P., Peiris, S., Simkin, M., Wang, Y.
10. The Application of No Barrier Theory to the Aldol Addition Reaction 2010 Guthrie, J.P.; Bannister, A. R.; Peiris, S.
11. Monte Carlo estimation of transverse and longitudinal correlation functions in the O(4) model 2010 J. Kaupužs, R.V.N. Melnik, J. Rimšāns
12. Parallelization of the Wolff single-cluster algorithm 2010 J. Kaupužs, R.V.N. Melnik, J. Rimšāns
13. Numerical solution of the Hartree-Fock equation in molecular geometries 2010 J. Talman Molecular Electronic Strucure
14. The Longest Common Extension problem revisited and an application to approximate string searchingJ. Discrete Alg 2010 L. Ilie, G. Navarro, and L. Tinta Bioinformatics And Computational Biology
15. Exploring the limits of 73Ge SSNMR at ultrahigh field 2010 A. Sutrisno, M.A. Hanson, P.A. Rupar, V.V. Terskikh, K.M. Baines*, Y. Huang* Nmr Spectrocopy
16. A solid-state 51V NMR investigation of the intercalation of alkylamines into layered alpha-vanadyl phosphate 2010 J. Zhu, Y. Huang Nmr Spectrocopy
17. Discovery and characterization of the laulimalide-microtubule binding mode by mass shift perturbation mapping 2010 Bennett MJ, Barakat K, Huzil JT, Tuszynski J, Schriemer DC
18. Ensemble-based virtual screening reveals dual-inhibitors for the p53-MDM2/MDMX interactions 2010 Barakat K, Mane J, Friesen D, Tuszynski J
19. Effect of Selective Accommodation on Soot Aggregate Shielding in Time-Resolved Laser-Induced Incandescence Experiments 2010 K. J. Daun Combustion Diagnostics
20. Parameter Estimation of Nonlinear Econometric Models Using Particle Swarm Optimization 2010 M.P. Wachowiak, R. Smolikova Wachowiak, D. Smolik Optimization And Signal Analysis