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David E Shaw

Showing results (51-60 of 142) with videos related to

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Journal of Chemical Theory and Computation|November 21, 2015
Assessing the Accuracy of Two Enhanced Sampling Methods Using EGFR Kinase Transition Pathways: The Influence of Collective Variable ChoiceAlbert C Pan, Thomas M Weinreich, Yibing Shan, et al.
Journal of Molecular Biology|October 27, 2010
Computational design and experimental testing of the fastest-folding β-sheet proteinStefano Piana, Krishnarjun Sarkar, Kresten Lindorff-Larsen, et al.
Annual Review of Biophysics|May 15, 2012
Biomolecular simulation: a computational microscope for molecular biologyRon O Dror, Robert M Dirks, J P Grossman, et al.
The Journal of Chemical Physics|March 3, 2005
Gaussian split Ewald: A fast Ewald mesh method for molecular simulationYibing Shan, John L Klepeis, Michael P Eastwood, et al.
Proceedings of the National Academy of Sciences of the United States of America|February 15, 2019
Atomic-level characterization of protein-protein associationAlbert C Pan, Daniel Jacobson, Konstantin Yatsenko, et al.
Nature Structural & Molecular Biology|July 24, 2012
Crystal structures of the JAK2 pseudokinase domain and the pathogenic mutant V617FRajintha M Bandaranayake, Daniela Ungureanu, Yibing Shan, et al.
Plos Computational Biology|March 3, 2022
How does a small molecule bind at a cryptic binding site?Yibing Shan, Venkatesh P Mysore, Abba E Leffler, et al.
The Journal of Physical Chemistry. B|July 12, 2013
Rotational relaxation in ortho-terphenyl: using atomistic simulations to bridge theory and experimentMichael P Eastwood, Tarun Chitra, John M Jumper, et al.
Plos One|March 3, 2012
Systematic validation of protein force fields against experimental dataKresten Lindorff-Larsen, Paul Maragakis, Stefano Piana, et al.
Journal of Chemical Information and Modeling|June 28, 2023
A Conserved Local Structural Motif Controls the Kinetics of PTP1B CatalysisChristine Y Yeh, Jesus A Izaguirre, Jack B Greisman, et al.
Pageof 15

Showing results (51-60 of 142) with videos related to

Sort By:
Pageof 15
Journal of Chemical Theory and Computation|November 21, 2015
Assessing the Accuracy of Two Enhanced Sampling Methods Using EGFR Kinase Transition Pathways: The Influence of Collective Variable ChoiceAlbert C Pan, Thomas M Weinreich, Yibing Shan, et al.
Journal of Molecular Biology|October 27, 2010
Computational design and experimental testing of the fastest-folding β-sheet proteinStefano Piana, Krishnarjun Sarkar, Kresten Lindorff-Larsen, et al.
Annual Review of Biophysics|May 15, 2012
Biomolecular simulation: a computational microscope for molecular biologyRon O Dror, Robert M Dirks, J P Grossman, et al.
The Journal of Chemical Physics|March 3, 2005
Gaussian split Ewald: A fast Ewald mesh method for molecular simulationYibing Shan, John L Klepeis, Michael P Eastwood, et al.
Proceedings of the National Academy of Sciences of the United States of America|February 15, 2019
Atomic-level characterization of protein-protein associationAlbert C Pan, Daniel Jacobson, Konstantin Yatsenko, et al.
Nature Structural & Molecular Biology|July 24, 2012
Crystal structures of the JAK2 pseudokinase domain and the pathogenic mutant V617FRajintha M Bandaranayake, Daniela Ungureanu, Yibing Shan, et al.
Plos Computational Biology|March 3, 2022
How does a small molecule bind at a cryptic binding site?Yibing Shan, Venkatesh P Mysore, Abba E Leffler, et al.
The Journal of Physical Chemistry. B|July 12, 2013
Rotational relaxation in ortho-terphenyl: using atomistic simulations to bridge theory and experimentMichael P Eastwood, Tarun Chitra, John M Jumper, et al.
Plos One|March 3, 2012
Systematic validation of protein force fields against experimental dataKresten Lindorff-Larsen, Paul Maragakis, Stefano Piana, et al.
Journal of Chemical Information and Modeling|June 28, 2023
A Conserved Local Structural Motif Controls the Kinetics of PTP1B CatalysisChristine Y Yeh, Jesus A Izaguirre, Jack B Greisman, et al.
Pageof 15