John L. Lewin, Ph.D.
Affiliations: | 2007 | University of Minnesota, Twin Cities, Minneapolis, MN |
Area:
Theoretical Chemistry, Molecular Modeling, Computational Chemistry, Structure, Reactivity, and MechanismGoogle:
"John Lewin"Mean distance: 9.06 | S | N | B | C | P |
Parents
Sign in to add mentor| Christopher J. Cramer | grad student | 2007 | UMN | |
| (Theoretical characterization of carbon-hydrogen bond activation in organometallic and biomimetic systems.) | ||||
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Publications
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| Lewin JL, Cramer CJ. (2008) Modified carbon pseudopotential for use in ONIOM calculations of alkyl-substituted metallocenes. The Journal of Physical Chemistry. A. 112: 12754-60 |
| Lewin JL, Heppner DE, Cramer CJ. (2007) Validation of density functional modeling protocols on experimental bis(mu-oxo)/mu-eta2:eta2-peroxo dicopper equilibria. Journal of Biological Inorganic Chemistry : Jbic : a Publication of the Society of Biological Inorganic Chemistry. 12: 1221-34 |
| Lewin JL, Woodrum NL, Cramer CJ. (2006) Density functional characterization of methane metathesis in ansa-[bis(η5-2-indenyl)methane]ML complexes [M = Sc, Y, Lu; L = CH3, CH2C(CH3)3] Organometallics. 25: 5906-5912 |
| Buck-Koehntop BA, Porcelli F, Lewin JL, et al. (2006) Biological chemistry of organotin compounds: Interactions and dealkylation by dithiols Journal of Organometallic Chemistry. 691: 1748-1755 |
| Lewin JL, Cramer CJ. (2004) Rapid quantum mechanical models for the computational estimation of C-H bond dissociation energies as a measure of metabolic stability. Molecular Pharmaceutics. 1: 128-35 |