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Physical Chemistry Chemical Physics : PCCP|February 27, 2018
Assessing AMBER force fields for protein folding in an implicit solventQiang Shao, Weiliang ZhuPhysical Chemistry Chemical Physics : PCCP|June 28, 2018
The effects of implicit modeling of nonpolar solvation on protein folding simulationsQiang Shao, Weiliang ZhuThe Journal of Physical Chemistry. B|September 4, 2019
Exploring the Ligand Binding/Unbinding Pathway by Selectively Enhanced Sampling of Ligand in a Protein-Ligand ComplexQiang Shao, Weiliang ZhuJournal of Chemical Theory and Computation|August 1, 2017
Effective Conformational Sampling in Explicit Solvent with Gaussian Biased Accelerated Molecular DynamicsQiang Shao, Weiliang ZhuPhysical Chemistry Chemical Physics : PCCP|April 2, 2019
Ligand binding effects on the activation of the EGFR extracellular domainQiang Shao, Weiliang ZhuPhysical Chemistry Chemical Physics : PCCP|May 29, 2019
Nonnative contact effects in protein foldingQiang Shao, Weiliang ZhuJournal of Chemical Theory and Computation|November 10, 2017
How Well Can Implicit Solvent Simulations Explore Folding Pathways? A Quantitative Analysis of α-Helix Bundle ProteinsQiang Shao, Weiliang ZhuPhysical Chemistry Chemical Physics : PCCP|May 9, 2019
Selective enhanced sampling in dihedral energy facilitates overcoming the dihedral energy increase in protein folding and accelerates the searching for protein native structureQiang Shao, Lijiang Yang, Weiliang ZhuThe Journal of Chemical Physics|March 8, 2013
Molecular dynamics simulation indicating cold denaturation of β-hairpinsQiang Shao, Jiye Shi, Weiliang ZhuThe Journal of Chemical Physics|October 2, 2012
Enhanced sampling molecular dynamics simulation captures experimentally suggested intermediate and unfolded states in the folding pathway of Trp-cage miniproteinQiang Shao, Jiye Shi, Weiliang ZhuPageof 61