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Richard A Friesner

Showing results (31-40 of 182) with videos related to

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Journal of Chemical Theory and Computation|December 18, 2014
Role of Desolvation in Thermodynamics and Kinetics of Ligand Binding to a KinaseJagannath Mondal, Richard A Friesner, B J Berne
Proceedings of the National Academy of Sciences of the United States of America|July 7, 2005
Computational prediction of native protein ligand-binding and enzyme active site sequencesRaj Chakrabarti, Alexander M Klibanov, Richard A Friesner
Proceedings of the National Academy of Sciences of the United States of America|August 17, 2005
Sequence optimization and designability of enzyme active sitesRaj Chakrabarti, Alexander M Klibanov, Richard A Friesner
The Journal of Chemical Physics|February 22, 2024
Highly efficient implementation of analytic nonadiabatic derivative couplings within the pseudospectral methodYixiang Cao, Mathew D Halls, Richard A Friesner
Proteins|September 10, 2011
Progress in super long loop predictionSuwen Zhao, Kai Zhu, Jianing Li, et al.
Journal of Chemical Theory and Computation|January 25, 2011
The prediction of Fe Mössbauer parameters by the density functional theory: a benchmark studyArteum D Bochevarov, Richard A Friesner, Stephen J Lippard
Journal of the American Chemical Society|January 20, 2005
Substrate hydroxylation in methane monooxygenase: quantitative modeling via mixed quantum mechanics/molecular mechanics techniquesBenjamin F Gherman, Stephen J Lippard, Richard A Friesner
Journal of the American Chemical Society|November 13, 2003
Theoretical study of cisplatin binding to purine bases: why does cisplatin prefer guanine over adenine?Mu-Hyun Baik, Richard A Friesner, Stephen J Lippard
Inorganic Chemistry|November 12, 2002
Ab initio quantum calculation of the diabatic coupling matrix elements for the self-exchange redox couples M(Cp)20/+ (M = Fe, Co; Cp = C5H5)Mu-Hyun Baik, Joseph B Crystal, Richard A Friesner
Nano Letters|March 12, 2014
Covalent O-H bonds as electron traps in proton-rich rutile TiO2 nanoparticlesJing Zhang, Michael Steigerwald, Louis Brus, et al.
Pageof 19

Showing results (31-40 of 182) with videos related to

Sort By:
Pageof 19
Journal of Chemical Theory and Computation|December 18, 2014
Role of Desolvation in Thermodynamics and Kinetics of Ligand Binding to a KinaseJagannath Mondal, Richard A Friesner, B J Berne
Proceedings of the National Academy of Sciences of the United States of America|July 7, 2005
Computational prediction of native protein ligand-binding and enzyme active site sequencesRaj Chakrabarti, Alexander M Klibanov, Richard A Friesner
Proceedings of the National Academy of Sciences of the United States of America|August 17, 2005
Sequence optimization and designability of enzyme active sitesRaj Chakrabarti, Alexander M Klibanov, Richard A Friesner
The Journal of Chemical Physics|February 22, 2024
Highly efficient implementation of analytic nonadiabatic derivative couplings within the pseudospectral methodYixiang Cao, Mathew D Halls, Richard A Friesner
Proteins|September 10, 2011
Progress in super long loop predictionSuwen Zhao, Kai Zhu, Jianing Li, et al.
Journal of Chemical Theory and Computation|January 25, 2011
The prediction of Fe Mössbauer parameters by the density functional theory: a benchmark studyArteum D Bochevarov, Richard A Friesner, Stephen J Lippard
Journal of the American Chemical Society|January 20, 2005
Substrate hydroxylation in methane monooxygenase: quantitative modeling via mixed quantum mechanics/molecular mechanics techniquesBenjamin F Gherman, Stephen J Lippard, Richard A Friesner
Journal of the American Chemical Society|November 13, 2003
Theoretical study of cisplatin binding to purine bases: why does cisplatin prefer guanine over adenine?Mu-Hyun Baik, Richard A Friesner, Stephen J Lippard
Inorganic Chemistry|November 12, 2002
Ab initio quantum calculation of the diabatic coupling matrix elements for the self-exchange redox couples M(Cp)20/+ (M = Fe, Co; Cp = C5H5)Mu-Hyun Baik, Joseph B Crystal, Richard A Friesner
Nano Letters|March 12, 2014
Covalent O-H bonds as electron traps in proton-rich rutile TiO2 nanoparticlesJing Zhang, Michael Steigerwald, Louis Brus, et al.
Pageof 19