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Physical Chemistry Chemical Physics : PCCP
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June 1, 2021
Extension of the CAVS model to the simulation of helical peptides in a membrane environment
Hujun Shen, Zhenhua Wu, Chan Lu
The Journal of Physical Chemistry. B
|
April 3, 2025
Neural Network-Based Molecular Dynamics Simulation of Water Assisted by Active Learning
Dan Zhao, Yao Huang, Hujun Shen
The Journal of Physical Chemistry. B
|
August 28, 2019
Effects of Ether Linkage on Membrane Dipole Potential and Cholesterol Flip-Flop Motion in Lipid Bilayer Membranes
Hujun Shen, Kun Zhao, Zhenhua Wu
Physical Chemistry Chemical Physics : PCCP
|
July 29, 2025
Binding of SARS-CoV-2 fusion peptides to hybrid phospholipid bilayers: exploring the influence of ether-linked phospholipids
Hujun Shen, Qingqing Wu, Ling Chen
Physical Chemistry Chemical Physics : PCCP
|
October 11, 2023
Simulating the isotropic Raman spectra of O-H stretching mode in liquid H<sub>2</sub>O based on a machine learning potential: the influence of vibrational couplings
Hujun Shen, Xu Shen, Zhenhua Wu
The Journal of Physical Chemistry. B
|
June 2, 2009
An improved functional form for the temperature scaling factors of the components of the mesoscopic UNRES force field for simulations of protein structure and dynamics
Hujun Shen, Adam Liwo, Harold A Scheraga
Journal of Computational Chemistry
|
September 29, 2011
Fast and accurate computation schemes for evaluating vibrational entropy of proteins
Beisi Xu, Hujun Shen, Xiao Zhu, et al.
Physical Chemistry Chemical Physics : PCCP
|
January 22, 2025
Revisiting the in-plane and in-channel diffusion of lithium ions in a solid-state electrolyte at room temperature through neural network-assisted molecular dynamics simulations
Yao Huang, Dan Zhao, Mingsen Deng, et al.
The Journal of Physical Chemistry. B
|
August 9, 2025
Neural Network-Assisted Analysis of Free O-H Orientational Distribution at the Air-Water Interface: Gaussian or Exponential?
Hujun Shen, Ling Chen, Jiaxin Li, et al.
The Journal of Physical Chemistry. B
|
January 5, 2013
Exploring the proton conductance and drug resistance of BM2 channel through molecular dynamics simulations and free energy calculations at different pH conditions
Yuxin Zhang, Hujun Shen, Mingbo Zhang, et al.
Page
of 6
Search research articles
Search
Showing results (11-20 of 58) with videos related to
Sort By:
Page
of 6
Physical Chemistry Chemical Physics : PCCP
|
June 1, 2021
Extension of the CAVS model to the simulation of helical peptides in a membrane environment
Hujun Shen, Zhenhua Wu, Chan Lu
The Journal of Physical Chemistry. B
|
April 3, 2025
Neural Network-Based Molecular Dynamics Simulation of Water Assisted by Active Learning
Dan Zhao, Yao Huang, Hujun Shen
The Journal of Physical Chemistry. B
|
August 28, 2019
Effects of Ether Linkage on Membrane Dipole Potential and Cholesterol Flip-Flop Motion in Lipid Bilayer Membranes
Hujun Shen, Kun Zhao, Zhenhua Wu
Physical Chemistry Chemical Physics : PCCP
|
July 29, 2025
Binding of SARS-CoV-2 fusion peptides to hybrid phospholipid bilayers: exploring the influence of ether-linked phospholipids
Hujun Shen, Qingqing Wu, Ling Chen
Physical Chemistry Chemical Physics : PCCP
|
October 11, 2023
Simulating the isotropic Raman spectra of O-H stretching mode in liquid H<sub>2</sub>O based on a machine learning potential: the influence of vibrational couplings
Hujun Shen, Xu Shen, Zhenhua Wu
The Journal of Physical Chemistry. B
|
June 2, 2009
An improved functional form for the temperature scaling factors of the components of the mesoscopic UNRES force field for simulations of protein structure and dynamics
Hujun Shen, Adam Liwo, Harold A Scheraga
Journal of Computational Chemistry
|
September 29, 2011
Fast and accurate computation schemes for evaluating vibrational entropy of proteins
Beisi Xu, Hujun Shen, Xiao Zhu, et al.
Physical Chemistry Chemical Physics : PCCP
|
January 22, 2025
Revisiting the in-plane and in-channel diffusion of lithium ions in a solid-state electrolyte at room temperature through neural network-assisted molecular dynamics simulations
Yao Huang, Dan Zhao, Mingsen Deng, et al.
The Journal of Physical Chemistry. B
|
August 9, 2025
Neural Network-Assisted Analysis of Free O-H Orientational Distribution at the Air-Water Interface: Gaussian or Exponential?
Hujun Shen, Ling Chen, Jiaxin Li, et al.
The Journal of Physical Chemistry. B
|
January 5, 2013
Exploring the proton conductance and drug resistance of BM2 channel through molecular dynamics simulations and free energy calculations at different pH conditions
Yuxin Zhang, Hujun Shen, Mingbo Zhang, et al.
Page
of 6