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Christopher J. Cramer

Showing results (91-100 of 271) with videos related to

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Journal of Chemical Theory and Computation|December 5, 2015
Charge Model 4 and Intramolecular Charge PolarizationRyan M Olson, Aleksandr V Marenich, Christopher J Cramer, et al.
Journal of the American Chemical Society|April 19, 2007
Transition state analysis of model and enzymatic prenylation reactionsStepan Lenevich, Juhua Xu, Ayako Hosokawa, et al.
Physical Chemistry Chemical Physics : PCCP|September 14, 2007
Benchmark RI-MP2 database of nucleic acid base trimers: performance of different density functional models for prediction of structures and binding energiesMartin Kabelác, Haydee Valdes, Edward C Sherer, et al.
Dalton Transactions (Cambridge, England : 2003)|October 13, 2006
Can an ancillary ligand lead to a thermodynamically stable end-on 1 : 1 Cu-O2 adduct supported by a beta-diketiminate ligand?David E Heppner, Benjamin F Gherman, William B Tolman, et al.
The Journal of Physical Chemistry. B|November 28, 2006
PdnCO (n = 1,2): accurate Ab initio bond energies, geometries, and dipole moments and the applicability of density functional theory for fuel cell modelingNathan E Schultz, Benjamin F Gherman, Christopher J Cramer, et al.
Journal of the American Chemical Society|July 28, 2007
Benzylic cations with triplet ground states: computational studies of aryl carbenium ions, silylenium ions, nitrenium ions, and oxenium ions substituted with meta pi donorsArthur H Winter, Daniel E Falvey, Christopher J Cramer, et al.
Organic Letters|August 4, 2009
Impact of solvent polarity on N-heterocyclic carbene-catalyzed beta-protonations of homoenolate equivalentsBrooks E Maki, Eric V Patterson, Christopher J Cramer, et al.
Journal of Computer-Aided Molecular Design|April 2, 2010
Prediction of SAMPL2 aqueous solvation free energies and tautomeric ratios using the SM8, SM8AD, and SMD solvation modelsRaphael F Ribeiro, Aleksandr V Marenich, Christopher J Cramer, et al.
Journal of Biological Inorganic Chemistry : JBIC : a Publication of the Society of Biological Inorganic Chemistry|December 14, 2005
Models for dioxygen activation by the CuB site of dopamine beta-monooxygenase and peptidylglycine alpha-hydroxylating monooxygenaseBenjamin F Gherman, David E Heppner, William B Tolman, et al.
The Journal of Physical Chemistry Letters|November 12, 2015
Influence of Coherent Tunneling and Incoherent Hopping on the Charge Transfer Mechanism in Linear Donor-Bridge-Acceptor SystemsGuangqi Li, Niranjan Govind, Mark A Ratner, et al.
Pageof 28

Showing results (91-100 of 271) with videos related to

Sort By:
Pageof 28
Journal of Chemical Theory and Computation|December 5, 2015
Charge Model 4 and Intramolecular Charge PolarizationRyan M Olson, Aleksandr V Marenich, Christopher J Cramer, et al.
Journal of the American Chemical Society|April 19, 2007
Transition state analysis of model and enzymatic prenylation reactionsStepan Lenevich, Juhua Xu, Ayako Hosokawa, et al.
Physical Chemistry Chemical Physics : PCCP|September 14, 2007
Benchmark RI-MP2 database of nucleic acid base trimers: performance of different density functional models for prediction of structures and binding energiesMartin Kabelác, Haydee Valdes, Edward C Sherer, et al.
Dalton Transactions (Cambridge, England : 2003)|October 13, 2006
Can an ancillary ligand lead to a thermodynamically stable end-on 1 : 1 Cu-O2 adduct supported by a beta-diketiminate ligand?David E Heppner, Benjamin F Gherman, William B Tolman, et al.
The Journal of Physical Chemistry. B|November 28, 2006
PdnCO (n = 1,2): accurate Ab initio bond energies, geometries, and dipole moments and the applicability of density functional theory for fuel cell modelingNathan E Schultz, Benjamin F Gherman, Christopher J Cramer, et al.
Journal of the American Chemical Society|July 28, 2007
Benzylic cations with triplet ground states: computational studies of aryl carbenium ions, silylenium ions, nitrenium ions, and oxenium ions substituted with meta pi donorsArthur H Winter, Daniel E Falvey, Christopher J Cramer, et al.
Organic Letters|August 4, 2009
Impact of solvent polarity on N-heterocyclic carbene-catalyzed beta-protonations of homoenolate equivalentsBrooks E Maki, Eric V Patterson, Christopher J Cramer, et al.
Journal of Computer-Aided Molecular Design|April 2, 2010
Prediction of SAMPL2 aqueous solvation free energies and tautomeric ratios using the SM8, SM8AD, and SMD solvation modelsRaphael F Ribeiro, Aleksandr V Marenich, Christopher J Cramer, et al.
Journal of Biological Inorganic Chemistry : JBIC : a Publication of the Society of Biological Inorganic Chemistry|December 14, 2005
Models for dioxygen activation by the CuB site of dopamine beta-monooxygenase and peptidylglycine alpha-hydroxylating monooxygenaseBenjamin F Gherman, David E Heppner, William B Tolman, et al.
The Journal of Physical Chemistry Letters|November 12, 2015
Influence of Coherent Tunneling and Incoherent Hopping on the Charge Transfer Mechanism in Linear Donor-Bridge-Acceptor SystemsGuangqi Li, Niranjan Govind, Mark A Ratner, et al.
Pageof 28