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Peter A Kollman

Showing results (1-10 of 22) with videos related to

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Journal of Computational Chemistry|October 24, 2002
pKa, MM, and QM studies of mechanisms of beta-lactamases and penicillin-binding proteins: acylation stepIrina Massova, Peter A Kollman
Journal of the American Chemical Society|October 17, 2002
Molecular dynamics simulation study of the negative correlation in antibody AZ28-catalyzed oxy-cope rearrangementToshio Asada, Hiroaki Gouda, Peter A Kollman
Journal of Computational Chemistry|September 18, 2004
Prediction of pKa shifts in proteins using a combination of molecular mechanical and continuum solvent calculationsBernd Kuhn, Peter A Kollman, Martin Stahl
Journal of Computational Chemistry|March 27, 2002
Computational alanine scanning of the 1:1 human growth hormone-receptor complexShuanghong Huo, Irina Massova, Peter A Kollman
Journal of Computational Chemistry|December 17, 2002
The intramolecular mechanism for the second proton transfer in triosephosphate isomerase (TIM): a QM/FE approachGiuliano Alagona, Caterina Ghio, Peter A Kollman
Proteins|May 10, 2002
Simulating proteins at constant pH: An approach combining molecular dynamics and Monte Carlo simulationRoland Bürgi, Peter A Kollman, Wilfred F Van Gunsteren
Journal of Medicinal Chemistry|December 12, 2003
Investigation of neuraminidase-substrate recognition using molecular dynamics and free energy calculationsKevin M Masukawa, Peter A Kollman, Irwin D Kuntz
Biopolymers|April 30, 2002
Conformational preferences of substituted prolines in the collagen triple helixSean D Mooney, Peter A Kollman, Teri E Klein
Journal of Medicinal Chemistry|April 2, 2005
Hierarchical database screenings for HIV-1 reverse transcriptase using a pharmacophore model, rigid docking, solvation docking, and MM-PB/SAJunmei Wang, Xinshan Kang, Irwin D Kuntz, et al.
Journal of Molecular Graphics & Modelling|February 7, 2006
Automatic atom type and bond type perception in molecular mechanical calculationsJunmei Wang, Wei Wang, Peter A Kollman, et al.
Pageof 3

Showing results (1-10 of 22) with videos related to

Sort By:
Pageof 3
Journal of Computational Chemistry|October 24, 2002
pKa, MM, and QM studies of mechanisms of beta-lactamases and penicillin-binding proteins: acylation stepIrina Massova, Peter A Kollman
Journal of the American Chemical Society|October 17, 2002
Molecular dynamics simulation study of the negative correlation in antibody AZ28-catalyzed oxy-cope rearrangementToshio Asada, Hiroaki Gouda, Peter A Kollman
Journal of Computational Chemistry|September 18, 2004
Prediction of pKa shifts in proteins using a combination of molecular mechanical and continuum solvent calculationsBernd Kuhn, Peter A Kollman, Martin Stahl
Journal of Computational Chemistry|March 27, 2002
Computational alanine scanning of the 1:1 human growth hormone-receptor complexShuanghong Huo, Irina Massova, Peter A Kollman
Journal of Computational Chemistry|December 17, 2002
The intramolecular mechanism for the second proton transfer in triosephosphate isomerase (TIM): a QM/FE approachGiuliano Alagona, Caterina Ghio, Peter A Kollman
Proteins|May 10, 2002
Simulating proteins at constant pH: An approach combining molecular dynamics and Monte Carlo simulationRoland Bürgi, Peter A Kollman, Wilfred F Van Gunsteren
Journal of Medicinal Chemistry|December 12, 2003
Investigation of neuraminidase-substrate recognition using molecular dynamics and free energy calculationsKevin M Masukawa, Peter A Kollman, Irwin D Kuntz
Biopolymers|April 30, 2002
Conformational preferences of substituted prolines in the collagen triple helixSean D Mooney, Peter A Kollman, Teri E Klein
Journal of Medicinal Chemistry|April 2, 2005
Hierarchical database screenings for HIV-1 reverse transcriptase using a pharmacophore model, rigid docking, solvation docking, and MM-PB/SAJunmei Wang, Xinshan Kang, Irwin D Kuntz, et al.
Journal of Molecular Graphics & Modelling|February 7, 2006
Automatic atom type and bond type perception in molecular mechanical calculationsJunmei Wang, Wei Wang, Peter A Kollman, et al.
Pageof 3