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Publications by SHARCNET researchers

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Title Published SHARCNET Authors Area
2181. Folding dynamics of the helical structure in proteins 2002 J. Kemp, J.Z.Y. Chen Soft Matter Physics
2182. Unzipping dsDNA with a force: numerical simulations 2002 J.Z.Y. Chen Soft Matter Physics
2183. Structural and folding properties of a lattice prion model 2002 A. Wind, J.P. Kemp, A. Ermoshkin, J.Z.Y. Chen Soft Matter Physics
2184. Adsorption of a protein to a lipid bilayer membrane 2002 A. Ermoshkin, J.Z.Y. Chen, P.-K. Lai Soft Matter Physics
2185. Open-to-closed transition of a hard-sphere chain with attractive ends 2002 Y.-J. Sheng, J.Z.Y. Chen, H.-K. Tsao Soft Matter Physics
2186. Structural Stability and Phase Transitions in K8Si46 Clathrate under High Pressure 2002 J.S.Tse, S. Desgrenier, Z.Q. Li, M.R. Ferguson, Y. Kawazoe Condensed Matter Physics
2187. Computer Modeling of the Structures, Stabilities, and Thermoelectric Efficiency of Materials with Clathrate Structures 2002 J.S. Tse, K. Uehara, Z.Q. Li, R. Rousseau, D.D. Klug Condensed Matter Physics
2188. High Performance thermoelectric materials with clathrate structures 2002 J.S. Tse, Z.Q. Li Condensed Matter Physics
2189. Vibrations of Methane in Structure I Clathrate Hydrate - an ab initio Density Functional Molecular Dynamics Study 2002 J.S. Tse Condensed Matter Physics
2190. An Analysis of Occupational Change and Departure from the Labor Force: Evidence of the Reasons that Teachers Leave 2002 T. Stinebrickner Applied Econometrics
2191. The Mechanism of the Addition of Non-enolizable Aldehydes and Ketones to (Di)metallenes (R2X=YR2, X=Si, Ge Y=C, Si, Ge): A Density Functional and Multiconfigurational Perturbation Theory Study 2002 N.J. Mosey, K.M. Baines, T.K. Woo Computational Chemistry
2192. Nature of mechanical instabilities and their effect on kinetic friction 2002 M. H. Müser Molecular Simulation
2193. Uncatalyzed and amine catalyzed decarboxylation of acetoacetic acid: an examination in terms of No Barrier Theory 2002 P. Guthrie Computational Chemistry
2194. Comparison of ab Initio and DFT Methods for Studying Chain Propagation and Chain Termination Processes with Group 4 Polymerization Catalysts. 1. The ansa-Bis(cyclopentadienyl)zirconium Catalyst 2002 G. Talarico, A. N. J. Blok, T. K. Woo, L. Cavallo Computational Chemistry
2195. Evaluating the impact of population bottlenecks in experimental evolution 2002 L. Wahl, P.J. Gerrish and I. Saika-Voivod Mathematical Biology
2196. Fragile-to-strong transition and polyamorphism in the energy landscape of liquid silica 2002 I. Saika-Voivod, P.H. Poole and F. Sciortino Condensed Matter Physics
2197. Interrelationship of fragile-to-strong and polyamorphic transitions in liquid silica 2002 I. Saika-Voivod, P.H. Poole and F. Sciortino Condensed Matter Physics
2198. Ab Initio Molecular Dynamics Simulations of Molecular Collisions of Nitromethane 2002 D. Wei, F. Zhang, T. Woo Computational Chemistry
2199. Ab Initio Molecular Dynamics Simulations of Multimolecular Collisions of Nitromethane and Compressed Liquid Nitromethane 2002 S.A. Decker, T.K. Woo, D. Wei, F. Zhang Computational Chemistry
2200. Molecular Modeling of Enantioselective Hydrosilylation by Chiral Pd Based Homogeneous Catalysts with First-Principles and Hybrid QM/MM Molecular Dynamics Simulations 2002 A. Magistrato, A. Togni, U. Rothlisberger, T.K. Woo Computational Chemistry