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Journal of Molecular Biology
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May 6, 2021
Cation-π Interactions and their Functional Roles in Membrane Proteins
Daniel T Infield, Ali Rasouli, Grace D Galles, et al.
Physical Chemistry Chemical Physics : PCCP
|
March 30, 2017
Structural and energetic study of cation-π-cation interactions in proteins
Silvana Pinheiro, Ignacio Soteras, Josep Lluis Gelpí, et al.
Journal of Chemical Theory and Computation
|
February 9, 2022
A Companion Guide to the String Method with Swarms of Trajectories: Characterization, Performance, and Pitfalls
Haochuan Chen, Dylan Ogden, Shashank Pant, et al.
The Journal of Physical Chemistry. B
|
November 6, 2024
Expanded Functionality and Portability for the Colvars Library
Giacomo Fiorin, Fabrizio Marinelli, Lucy R Forrest, et al.
Antioxidants (Basel, Switzerland)
|
October 30, 2019
Targeting G-quadruplexes with Organic Dyes: Chelerythrine-DNA Binding Elucidated by Combining Molecular Modeling and Optical Spectroscopy
Alessio Terenzi, Hugo Gattuso, Angelo Spinello, et al.
Journal of Chemical Theory and Computation
|
January 16, 2026
Following the Committor Flow: A Data-Driven Discovery of Transition Pathways
Cheng Giuseppe Chen, Chenyu Tang, Alberto Megías, et al.
Nature Communications
|
August 26, 2022
Perforin-2 clockwise hand-over-hand pre-pore to pore transition mechanism
Fang Jiao, François Dehez, Tao Ni, et al.
Journal of Chemical Theory and Computation
|
November 28, 2018
Correction to Constant-pH Molecular Dynamics Simulations for Large Biomolecular Systems
Brian K Radak, Christophe Chipot, Donghyuk Suh, et al.
Journal of Chemical Theory and Computation
|
November 8, 2017
Constant-pH Molecular Dynamics Simulations for Large Biomolecular Systems
Brian K Radak, Christophe Chipot, Donghyuk Suh, et al.
Journal of Chemical Information and Modeling
|
August 18, 2020
Boosting Free-Energy Perturbation Calculations with GPU-Accelerated NAMD
Haochuan Chen, Julio D C Maia, Brian K Radak, et al.
Page
of 20
Search research articles
Search
Showing results (151-160 of 191) with videos related to
Sort By:
Page
of 20
Journal of Molecular Biology
|
May 6, 2021
Cation-π Interactions and their Functional Roles in Membrane Proteins
Daniel T Infield, Ali Rasouli, Grace D Galles, et al.
Physical Chemistry Chemical Physics : PCCP
|
March 30, 2017
Structural and energetic study of cation-π-cation interactions in proteins
Silvana Pinheiro, Ignacio Soteras, Josep Lluis Gelpí, et al.
Journal of Chemical Theory and Computation
|
February 9, 2022
A Companion Guide to the String Method with Swarms of Trajectories: Characterization, Performance, and Pitfalls
Haochuan Chen, Dylan Ogden, Shashank Pant, et al.
The Journal of Physical Chemistry. B
|
November 6, 2024
Expanded Functionality and Portability for the Colvars Library
Giacomo Fiorin, Fabrizio Marinelli, Lucy R Forrest, et al.
Antioxidants (Basel, Switzerland)
|
October 30, 2019
Targeting G-quadruplexes with Organic Dyes: Chelerythrine-DNA Binding Elucidated by Combining Molecular Modeling and Optical Spectroscopy
Alessio Terenzi, Hugo Gattuso, Angelo Spinello, et al.
Journal of Chemical Theory and Computation
|
January 16, 2026
Following the Committor Flow: A Data-Driven Discovery of Transition Pathways
Cheng Giuseppe Chen, Chenyu Tang, Alberto Megías, et al.
Nature Communications
|
August 26, 2022
Perforin-2 clockwise hand-over-hand pre-pore to pore transition mechanism
Fang Jiao, François Dehez, Tao Ni, et al.
Journal of Chemical Theory and Computation
|
November 28, 2018
Correction to Constant-pH Molecular Dynamics Simulations for Large Biomolecular Systems
Brian K Radak, Christophe Chipot, Donghyuk Suh, et al.
Journal of Chemical Theory and Computation
|
November 8, 2017
Constant-pH Molecular Dynamics Simulations for Large Biomolecular Systems
Brian K Radak, Christophe Chipot, Donghyuk Suh, et al.
Journal of Chemical Information and Modeling
|
August 18, 2020
Boosting Free-Energy Perturbation Calculations with GPU-Accelerated NAMD
Haochuan Chen, Julio D C Maia, Brian K Radak, et al.
Page
of 20