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Journal of Chemical Theory and Computation
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December 11, 2023
Improved Sampling of Adaptive Path Collective Variables by Stabilized Extended-System Dynamics
Andreas Hulm, Christian Ochsenfeld
Journal of Chemical Theory and Computation
|
June 18, 2025
Combining Fast Exploration with Accurate Reweighting in the OPES-eABF Hybrid Sampling Method
Andreas Hulm, Robert P Schiller, Christian Ochsenfeld
Journal of Chemical Theory and Computation
|
September 19, 2025
Molecular Mechanism of ATP Hydrolysis Catalyzed by p97: A QM/MM Study
Judit Katalin Szántó, Andreas Hulm, Christian Ochsenfeld
The Journal of Chemical Physics
|
July 15, 2022
Statistically optimal analysis of the extended-system adaptive biasing force (eABF) method
Andreas Hulm, Johannes C B Dietschreit, Christian Ochsenfeld
ACS Central Science
|
March 4, 2024
Exploring Chemical Space Using <i>Ab Initio</i> Hyperreactor Dynamics
Alexandra Stan-Bernhardt, Liubov Glinkina, Andreas Hulm, et al.
The Journal of Chemical Physics
|
September 1, 2022
From free-energy profiles to activation free energies
Johannes C B Dietschreit, Dennis J Diestler, Andreas Hulm, et al.
Journal of Chemical Theory and Computation
|
May 8, 2024
QM/MM Free Energy Calculations of Long-Range Biological Protonation Dynamics by Adaptive and Focused Sampling
Maximilian C Pöverlein, Andreas Hulm, Johannes C B Dietschreit, et al.
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of 1
Search research articles
Search
Showing results (1-10 of 7) with videos related to
Sort By:
Page
of 1
Journal of Chemical Theory and Computation
|
December 11, 2023
Improved Sampling of Adaptive Path Collective Variables by Stabilized Extended-System Dynamics
Andreas Hulm, Christian Ochsenfeld
Journal of Chemical Theory and Computation
|
June 18, 2025
Combining Fast Exploration with Accurate Reweighting in the OPES-eABF Hybrid Sampling Method
Andreas Hulm, Robert P Schiller, Christian Ochsenfeld
Journal of Chemical Theory and Computation
|
September 19, 2025
Molecular Mechanism of ATP Hydrolysis Catalyzed by p97: A QM/MM Study
Judit Katalin Szántó, Andreas Hulm, Christian Ochsenfeld
The Journal of Chemical Physics
|
July 15, 2022
Statistically optimal analysis of the extended-system adaptive biasing force (eABF) method
Andreas Hulm, Johannes C B Dietschreit, Christian Ochsenfeld
ACS Central Science
|
March 4, 2024
Exploring Chemical Space Using <i>Ab Initio</i> Hyperreactor Dynamics
Alexandra Stan-Bernhardt, Liubov Glinkina, Andreas Hulm, et al.
The Journal of Chemical Physics
|
September 1, 2022
From free-energy profiles to activation free energies
Johannes C B Dietschreit, Dennis J Diestler, Andreas Hulm, et al.
Journal of Chemical Theory and Computation
|
May 8, 2024
QM/MM Free Energy Calculations of Long-Range Biological Protonation Dynamics by Adaptive and Focused Sampling
Maximilian C Pöverlein, Andreas Hulm, Johannes C B Dietschreit, et al.
Page
of 1