Showing results (191-200 of 581) with videos related to
Sort By:
Pageof 59
The Journal of Physical Chemistry. B|October 8, 2016
The Activation of c-Src Tyrosine Kinase: Conformational Transition Pathway and Free Energy LandscapeMikolai Fajer, Yilin Meng, Benoît RouxJournal of Molecular Biology|September 29, 2004
Structural determinants of proton blockage in aquaporinsNilmadhab Chakrabarti, Benoît Roux, Régis PomèsBiophysical Journal|November 24, 2004
Rapid intracellular TEA block of the KcsA potassium channelEsin Kutluay, Benoît Roux, Lise HeginbothamProceedings of the National Academy of Sciences of the United States of America|August 19, 2007
On the importance of a funneled energy landscape for the assembly and regulation of multidomain Src tyrosine kinasesJosé D Faraldo-Gómez, Benoît RouxThe Journal of Physical Chemistry Letters|March 25, 2021
Nanomachine-Assisted Ion Transport Across Membranes: From Mechanism to Rational Design and ApplicationsHong Zhang, Yichang Guo, Christophe Chipot, et al.Journal of Computational Chemistry|September 4, 2019
Modulation of membrane permeability by carbon dioxideHong Zhang, Xueguang Shao, François Dehez, et al.Journal of Chemical Theory and Computation|June 14, 2021
Accuracy of Alternate Nonpolarizable Force Fields for the Determination of Protein-Ligand Binding Affinities Dominated by Cation-π InteractionsHan Liu, Haohao Fu, Christophe Chipot, et al.Journal of Chemical Information and Modeling|June 7, 2018
ELF: An Extended-Lagrangian Free Energy Calculation Module for Multiple Molecular Dynamics EnginesHaochuan Chen, Haohao Fu, Xueguang Shao, et al.The Journal of Physical Chemistry. B|May 12, 2009
Inclusion mechanism of steroid drugs into beta-cyclodextrins. Insights from free energy calculationsWensheng Cai, Tingting Sun, Peng Liu, et al.Nature Computational Science|June 18, 2025
A formally exact method for high-throughput absolute binding-free-energy calculationsHengwei Bian, Xueguang Shao, Christophe Chipot, et al.Pageof 59