TGQR 2010Q4 Report.pdf - Teragridforum.org
TGQR 2010Q4 Report.pdf - Teragridforum.org
TGQR 2010Q4 Report.pdf - Teragridforum.org
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208. J B. Clemens, E. A. Chagarov, M. Holland, R. Droopad, J Shen, and A. C. Kummel “Atomic<br />
imaging of the monolayer nucleation and unpinning of a compound semiconductor surface during atomic<br />
layer deposition” J. Chem. Phys. (submitted) (2010)<br />
209. S. R. Bishop, J. B. Clemens, E. A. Chagarov, and A. C. Kummel “Theoretical analysis of initial<br />
adsorption high-κ dielectric oxides on group III rich InxGa1-xAs(0 0 1)-(4×2) surfaces” J. Chem. Phys.<br />
(submitted) (2010)<br />
210. Jian Shen, Evgueni A. Chagarov, Darby L. Feldwinn, Wilhelm Melitz, Nancy M.Santagata and<br />
Andrew C. Kummel, Ravi Droopad, Matthias Passlack, “Scanning Tunneling Microscopy/Spectroscopy<br />
Study of Atomic and Electronic Structures of In2O on InAs and In0.53Ga0.47As(001)-(4×2) Surfaces”, J.<br />
Chem Phys. (submitted) (2010).<br />
CHE090062<br />
211. Deborah L. Heyl, Joshua M. Osborne, Sarika Pamarthy, Shyamprasad Samisetti, Andrew W. Gray,<br />
Anitha Jayaprakash, Srikanth Konda, Dorothy J. Brown, Samuel R. Miller, Reza Eizadkhah, Maria C. Milletti<br />
‘Liposome Damage and Modeling of Fragments of Human Islet Amyloid Polypeptide (IAPP) Support a Two-<br />
Step Model of Membrane Destruction’ International Journal of Peptide Research and Therapeutics, 2010,<br />
16, 43.<br />
212. Mark A. Lukowski, Dae Jin Choi and M.C. Milletti ‘Substrate Binding and Kinetic Aspects of the<br />
Peroxidation Reaction of Four Polyunsaturated Fatty Acids in the COX Active Site of PGHS-1’ Letters in<br />
Drug Design and Discovery, 2010, 7, 88-97.<br />
213. Mark Lukowski, Kathryn Jacobs, Powen Hsueh, Harriet A. Lindsay and M.C. Milletti<br />
‘Thermodynamic and kinetic factors in the aza-Cope rearrangement of a series of iminium cations’<br />
Tetrahedron 2009, 65, 10311-10316.<br />
CHE090066<br />
214. Yang, Q.; Huang, Z.; Khvostichenko, D.; Kucharski, T.; Chen, J.; Boulatov, R. A molecular force<br />
probe. Nature Nanotech. 2009, 4, 302-306.<br />
215. Huang, Z.; Boulatov, R. Exploring chemimechanics with molecular force probes (invited review).<br />
Pure Appl. Chem. 2010, 86, 931-952.<br />
216. Kucharski, T.; Yang, Q.; Huang, Z.; Tian, Y.; Rubin, N. J.; Concepcion, C. J.; Boulatov, R. Kinetics<br />
of thiol/disulfide exchange correlates weakly with the restoring force of the disulfide moiety. Angew. Chem.<br />
Int. Ed., 2009, 48, 7040 - 7043.<br />
217. Huang, Z.; Yang, Q.; Kucharski, T.; Khvostichenko, D.; Wakeman, S. M.; Boulatov, R. Macrocyclic<br />
disulfides for studies of sensitized photolysis of the S-S bond. Chem. Eur. J., 2009, 15, 5212-5214.<br />
218. Huang, Z.; Yang, Q.; Khvostichenko, D.; Kucharski, T.J.; Chen, J.; Boulatov, R. Method to derive<br />
restoring forces of strained molecules from kinetic measurements. J. Am. Chem. Soc. 2009, 131, 1407-1409<br />
CHE090070<br />
219. Xu, L.; Doubleday, C. E.; Houk, K. N. “Dynamics of 1,3-Dipolar Cycloaddition Reactions of<br />
Diazonium Betaines to Acetylene and Ethylene: Bending Vibrations Facilitate Reaction” Angew. Chem. Int.<br />
Ed. 2009, 48, 2746-2748.<br />
220. Xu, L.; Doubleday, C. E.; Houk, K. N. “Dynamics of 1,3-Dipolar Cycloadditions: Energy Partitioning<br />
of Reactants and Quantitation of Synchronicity” J. Am. Chem. Soc. 2010, 132, 3029–3037.<br />
221. Doubleday, C.; Bohnen, M. “Statistical and Nonstatistical Dynamics in a Thermal Rearrangement<br />
with Competing 1,3 and 3,3 Shifts”.