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Journal of Molecular Modeling
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July 10, 2016
Examination of the quality of various force fields and solvation models for the equilibrium simulations of GA88 and GB88
Juan Zeng, Yongxiu Li, John Z H Zhang, et al.
Journal of Chemical Theory and Computation
|
October 19, 2018
Accelerated Computation of Free Energy Profile at ab Initio Quantum Mechanical/Molecular Mechanics Accuracy via a Semi-Empirical Reference Potential. I. Weighted Thermodynamics Perturbation
Pengfei Li, Xiangyu Jia, Xiaoliang Pan, et al.
Journal of Chemical Information and Modeling
|
January 19, 2017
Evaluation of the Coupled Two-Dimensional Main Chain Torsional Potential in Modeling Intrinsically Disordered Proteins
Ya Gao, Chaomin Zhang, John Z H Zhang, et al.
Journal of Computational Chemistry
|
January 3, 2013
A numerically stable restrained electrostatic potential charge fitting method
Juan Zeng, LiLi Duan, John Z H Zhang, et al.
Journal of Chemical Theory and Computation
|
December 10, 2019
Benchmarking the Performance of Time-Dependent Density Functional Theory Methods on Biochromophores
Yihan Shao, Ye Mei, Dage Sundholm, et al.
The Journal of Chemical Physics
|
May 10, 2011
Communication: The electrostatic polarization is essential to differentiate the helical propensity in polyalanine mutants
Caiyi Wei, Dickson Tung, Yew Mun Yip, et al.
Journal of the American Chemical Society
|
June 3, 2009
Simulation of NMR data reveals that proteins' local structures are stabilized by electronic polarization
Yan Tong, Chang G Ji, Ye Mei, et al.
Journal of Computational Chemistry
|
June 15, 2007
Efficient bond function basis set for pi-pi interaction energies
Yun Ding, Ye Mei, John Z H Zhang, et al.
Journal of Computational Chemistry
|
April 3, 2012
Electrostatic polarization is critical for the strong binding in streptavidin-biotin system
Ye Mei, Yong L Li, Juan Zeng, et al.
The Journal of Physical Chemistry. B
|
May 28, 2025
Rational Enzyme Evolution by Facilitating Correlated Motion along the Reaction
Lianxin Wang, Yuanfei Xue, Jia-Ning Wang, et al.
Page
of 12
Search research articles
Search
Showing results (31-40 of 116) with videos related to
Sort By:
Page
of 12
Journal of Molecular Modeling
|
July 10, 2016
Examination of the quality of various force fields and solvation models for the equilibrium simulations of GA88 and GB88
Juan Zeng, Yongxiu Li, John Z H Zhang, et al.
Journal of Chemical Theory and Computation
|
October 19, 2018
Accelerated Computation of Free Energy Profile at ab Initio Quantum Mechanical/Molecular Mechanics Accuracy via a Semi-Empirical Reference Potential. I. Weighted Thermodynamics Perturbation
Pengfei Li, Xiangyu Jia, Xiaoliang Pan, et al.
Journal of Chemical Information and Modeling
|
January 19, 2017
Evaluation of the Coupled Two-Dimensional Main Chain Torsional Potential in Modeling Intrinsically Disordered Proteins
Ya Gao, Chaomin Zhang, John Z H Zhang, et al.
Journal of Computational Chemistry
|
January 3, 2013
A numerically stable restrained electrostatic potential charge fitting method
Juan Zeng, LiLi Duan, John Z H Zhang, et al.
Journal of Chemical Theory and Computation
|
December 10, 2019
Benchmarking the Performance of Time-Dependent Density Functional Theory Methods on Biochromophores
Yihan Shao, Ye Mei, Dage Sundholm, et al.
The Journal of Chemical Physics
|
May 10, 2011
Communication: The electrostatic polarization is essential to differentiate the helical propensity in polyalanine mutants
Caiyi Wei, Dickson Tung, Yew Mun Yip, et al.
Journal of the American Chemical Society
|
June 3, 2009
Simulation of NMR data reveals that proteins' local structures are stabilized by electronic polarization
Yan Tong, Chang G Ji, Ye Mei, et al.
Journal of Computational Chemistry
|
June 15, 2007
Efficient bond function basis set for pi-pi interaction energies
Yun Ding, Ye Mei, John Z H Zhang, et al.
Journal of Computational Chemistry
|
April 3, 2012
Electrostatic polarization is critical for the strong binding in streptavidin-biotin system
Ye Mei, Yong L Li, Juan Zeng, et al.
The Journal of Physical Chemistry. B
|
May 28, 2025
Rational Enzyme Evolution by Facilitating Correlated Motion along the Reaction
Lianxin Wang, Yuanfei Xue, Jia-Ning Wang, et al.
Page
of 12