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Morgan Lawrenz

Showing results (1-10 of 16) with videos related to

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Journal of Chemical Theory and Computation|May 23, 2009
Independent-Trajectories Thermodynamic-Integration Free-Energy Changes for Biomolecular Systems: Determinants of H5N1 Avian Influenza Virus Neuraminidase Inhibition by PeramivirMorgan Lawrenz, Riccardo Baron, J Andrew McCammon
Methods in Enzymology|May 8, 2015
Elucidating Ligand-Modulated Conformational Landscape of GPCRs Using Cloud-Computing ApproachesDiwakar Shukla, Morgan Lawrenz, Vijay S Pande
Scientific Reports|January 23, 2015
Cloud computing approaches for prediction of ligand binding poses and pathwaysMorgan Lawrenz, Diwakar Shukla, Vijay S Pande
Methods in Molecular Biology (Clifton, N.J.)|December 21, 2011
Independent-Trajectory Thermodynamic Integration: a practical guide to protein-drug binding free energy calculations using distributed computingMorgan Lawrenz, Riccardo Baron, Yi Wang, et al.
Journal of Chemical Theory and Computation|August 4, 2011
Effects of Biomolecular Flexibility on Alchemical Calculations of Absolute Binding Free EnergiesMorgan Lawrenz, Riccardo Baron, Yi Wang, et al.
Nature Communications|June 16, 2015
A network of molecular switches controls the activation of the two-component response regulator NtrCDan K Vanatta, Diwakar Shukla, Morgan Lawrenz, et al.
Proteins|July 6, 2010
Impact of calcium on N1 influenza neuraminidase dynamics and binding free energyMorgan Lawrenz, Jeff Wereszczynski, Rommie Amaro, et al.
Journal of Computer-Aided Molecular Design|February 22, 2012
Thermodynamic integration to predict host-guest binding affinitiesMorgan Lawrenz, Jeff Wereszczynski, Juan Manuel Ortiz-Sánchez, et al.
Chemical Communications (Cambridge, England)|August 27, 2010
Porous protein frameworks with unsaturated metal centers in sterically encumbered coordination sitesRobert J Radford, Morgan Lawrenz, Phuong C Nguyen, et al.
Journal of Chemical Theory and Computation|October 23, 2024
Elucidating Protein Structures in the Gas Phase: Traversing Configuration Space with Biasing MethodsViraj D Gandhi, Leyan Hua, Morgan Lawrenz, et al.
Pageof 2

Showing results (1-10 of 16) with videos related to

Sort By:
Pageof 2
Journal of Chemical Theory and Computation|May 23, 2009
Independent-Trajectories Thermodynamic-Integration Free-Energy Changes for Biomolecular Systems: Determinants of H5N1 Avian Influenza Virus Neuraminidase Inhibition by PeramivirMorgan Lawrenz, Riccardo Baron, J Andrew McCammon
Methods in Enzymology|May 8, 2015
Elucidating Ligand-Modulated Conformational Landscape of GPCRs Using Cloud-Computing ApproachesDiwakar Shukla, Morgan Lawrenz, Vijay S Pande
Scientific Reports|January 23, 2015
Cloud computing approaches for prediction of ligand binding poses and pathwaysMorgan Lawrenz, Diwakar Shukla, Vijay S Pande
Methods in Molecular Biology (Clifton, N.J.)|December 21, 2011
Independent-Trajectory Thermodynamic Integration: a practical guide to protein-drug binding free energy calculations using distributed computingMorgan Lawrenz, Riccardo Baron, Yi Wang, et al.
Journal of Chemical Theory and Computation|August 4, 2011
Effects of Biomolecular Flexibility on Alchemical Calculations of Absolute Binding Free EnergiesMorgan Lawrenz, Riccardo Baron, Yi Wang, et al.
Nature Communications|June 16, 2015
A network of molecular switches controls the activation of the two-component response regulator NtrCDan K Vanatta, Diwakar Shukla, Morgan Lawrenz, et al.
Proteins|July 6, 2010
Impact of calcium on N1 influenza neuraminidase dynamics and binding free energyMorgan Lawrenz, Jeff Wereszczynski, Rommie Amaro, et al.
Journal of Computer-Aided Molecular Design|February 22, 2012
Thermodynamic integration to predict host-guest binding affinitiesMorgan Lawrenz, Jeff Wereszczynski, Juan Manuel Ortiz-Sánchez, et al.
Chemical Communications (Cambridge, England)|August 27, 2010
Porous protein frameworks with unsaturated metal centers in sterically encumbered coordination sitesRobert J Radford, Morgan Lawrenz, Phuong C Nguyen, et al.
Journal of Chemical Theory and Computation|October 23, 2024
Elucidating Protein Structures in the Gas Phase: Traversing Configuration Space with Biasing MethodsViraj D Gandhi, Leyan Hua, Morgan Lawrenz, et al.
Pageof 2