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Donald Hamelberg

Showing results (71-80 of 104) with videos related to

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The Journal of Chemical Physics|October 24, 2007
Sampling of slow diffusive conformational transitions with accelerated molecular dynamicsDonald Hamelberg, César Augusto F de Oliveira, J Andrew McCammon
The Journal of Physical Chemistry. B|November 10, 2006
On the application of accelerated molecular dynamics to liquid water simulationsCésar Augusto F de Oliveira, Donald Hamelberg, J Andrew McCammon
Medicinal Research Reviews|September 15, 2022
Computational benchmarking of putative KIFC1 inhibitorsNivya Sharma, Dani Setiawan, Donald Hamelberg, et al.
Journal of Chemical Theory and Computation|May 23, 2009
Coupling Accelerated Molecular Dynamics Methods with Thermodynamic Integration SimulationsCésar Augusto F de Oliveira, Donald Hamelberg, J Andrew McCammon
The Journal of Chemical Physics|November 13, 2007
Estimating kinetic rates from accelerated molecular dynamics simulations: alanine dipeptide in explicit solvent as a case studyCésar Augusto F de Oliveira, Donald Hamelberg, J Andrew McCammon
Chemical Communications (Cambridge, England)|December 14, 2011
Clicking 1,2,4,5-tetrazine and cyclooctynes with tunable reaction ratesWeixuan Chen, Danzhu Wang, Chaofeng Dai, et al.
Proteins|May 9, 2009
The role of conserved water molecules in the catalytic domain of protein kinasesJames D R Knight, Donald Hamelberg, J Andrew McCammon, et al.
Biochemistry|December 13, 2025
Mechanistic and Molecular Dynamics Studies Reveal that Increased Loop 3 Mobility Alters Substrate Capture in an NADH:Quinone OxidoreductaseBenjamin D Dratch, Daniel Ouedraogo, Jacob Ball, et al.
Biochemistry|February 16, 2023
Non-active Site Residue in Loop L4 Alters Substrate Capture and Product Release in d-Arginine DehydrogenaseDaniel Ouedraogo, Michael Souffrant, Xin-Qiu Yao, et al.
FASEB Journal : Official Publication of the Federation of American Societies for Experimental Biology|August 30, 2005
The folding energy landscape and phosphorylation: modeling the conformational switch of the NFAT regulatory domainTongye Shen, Chenghang Zong, Donald Hamelberg, et al.
Pageof 11

Showing results (71-80 of 104) with videos related to

Sort By:
Pageof 11
The Journal of Chemical Physics|October 24, 2007
Sampling of slow diffusive conformational transitions with accelerated molecular dynamicsDonald Hamelberg, César Augusto F de Oliveira, J Andrew McCammon
The Journal of Physical Chemistry. B|November 10, 2006
On the application of accelerated molecular dynamics to liquid water simulationsCésar Augusto F de Oliveira, Donald Hamelberg, J Andrew McCammon
Medicinal Research Reviews|September 15, 2022
Computational benchmarking of putative KIFC1 inhibitorsNivya Sharma, Dani Setiawan, Donald Hamelberg, et al.
Journal of Chemical Theory and Computation|May 23, 2009
Coupling Accelerated Molecular Dynamics Methods with Thermodynamic Integration SimulationsCésar Augusto F de Oliveira, Donald Hamelberg, J Andrew McCammon
The Journal of Chemical Physics|November 13, 2007
Estimating kinetic rates from accelerated molecular dynamics simulations: alanine dipeptide in explicit solvent as a case studyCésar Augusto F de Oliveira, Donald Hamelberg, J Andrew McCammon
Chemical Communications (Cambridge, England)|December 14, 2011
Clicking 1,2,4,5-tetrazine and cyclooctynes with tunable reaction ratesWeixuan Chen, Danzhu Wang, Chaofeng Dai, et al.
Proteins|May 9, 2009
The role of conserved water molecules in the catalytic domain of protein kinasesJames D R Knight, Donald Hamelberg, J Andrew McCammon, et al.
Biochemistry|December 13, 2025
Mechanistic and Molecular Dynamics Studies Reveal that Increased Loop 3 Mobility Alters Substrate Capture in an NADH:Quinone OxidoreductaseBenjamin D Dratch, Daniel Ouedraogo, Jacob Ball, et al.
Biochemistry|February 16, 2023
Non-active Site Residue in Loop L4 Alters Substrate Capture and Product Release in d-Arginine DehydrogenaseDaniel Ouedraogo, Michael Souffrant, Xin-Qiu Yao, et al.
FASEB Journal : Official Publication of the Federation of American Societies for Experimental Biology|August 30, 2005
The folding energy landscape and phosphorylation: modeling the conformational switch of the NFAT regulatory domainTongye Shen, Chenghang Zong, Donald Hamelberg, et al.
Pageof 11