Lei Liu

发表

Turn-Directed α-β Conformational Transition of α-syn12 Peptide at Different pH Revealed by Unbiased Molecular Dynamics Simulations

Z. Cao, Lei Liu, Zanxia Cao, 2013, International journal of molecular sciences.

Different effects of cholesterol on membrane permeation of arginine and tryptophan revealed by bias-exchange metadynamics simulations.

Yaoqi Zhou, Jihua Wang, Z. Cao, 2019, The Journal of chemical physics.

Molecular dynamics simulations to study the role of biphenylalanine in promoting the antibacterial activity of ultrashort peptides.

Z. Cao, Liling Zhao, Lei Liu, 2022, Journal of molecular graphics & modelling.

Effect of pH on the Aggregation of α-syn12 Dimer in Explicit Water by Replica-Exchange Molecular Dynamics Simulation

Jihua Wang, Z. Cao, Liling Zhao, 2015, International journal of molecular sciences.

Comparison of the structural characteristics of Cu2+-bound and unbound α-syn12 peptide obtained in simulations using different force fields

Jihua Wang, Z. Cao, Liling Zhao, 2013, Journal of Molecular Modeling.

Well-Ordered Structure at Ionic Liquid/Rutile (110) Interface

Xueping Gao, Zhen Cao, Shu Li, 2007 .

Chemical Dynamics Simulation of Ne Atom Scattering off a Squalane Surface

Zhen Cao, Shu Li, T. Yan, 2008 .

Effects of Different Force Fields and Temperatures on the Structural Character of Abeta (12–28) Peptide in Aqueous Solution

Jihua Wang, Liling Zhao, Lei Liu, 2011, International journal of molecular sciences.

Structural and thermodynamics characters of isolated α-syn12 peptide: long-time temperature replica-exchange molecular dynamics in aqueous solution.

Jihua Wang, Lei Liu, Zanxia Cao, 2011, Acta biochimica et biophysica Sinica.

Interplay of hydrophobic and hydrophilic interactions in sequence-dependent cell penetration of spontaneous membrane-translocating peptides revealed by bias-exchange metadynamics simulations.

Yaoqi Zhou, Jihua Wang, Guodong Hu, 2020, Biochimica et biophysica acta. Biomembranes.

Why the OPLS-AA Force Field Cannot Produce the β-Hairpin Structure of H1 Peptide in Solution When Comparing with the GROMOS 43A1 Force Field?

Jihua Wang, Lei Liu, Zanxia Cao, 2011, Journal of biomolecular structure & dynamics.

Molecular Dynamics Simulation of Fullerene C60 in Ethanol Solution

Zhen Cao, Shu Li, T. Yan, 2009 .

A reactive molecular dynamics simulation of the atomic oxygen impact on poly(p-phenylene-terephthalamide)

Changqing Miao, Lei Liu, Wenxiang Liu, 2023, Computational Materials Science.

Molecular dynamics study of the structural character of α-syn12 peptide bound to Synphilin-1 protein

Lei Liu, 2010, 2010 International Conference on Future Information Technology and Management Engineering.

Effects of pH and Temperature on the Structural and Thermodynamic Character of a-syn12 Peptide in Aqueous Solution

Jihua Wang, Lei Liu, Zanxia Cao, 2010, Journal of biomolecular structure & dynamics.

Influence of Different Aromatic Hydrophobic Residues on the Antimicrobial Activity and Membrane Selectivity of BRBR-NH2 Tetrapeptide.

Jihua Wang, Liling Zhao, S. Yue, 2020, Langmuir.

Effects of C-Terminal Lys-Arg Residue of AapA1 Protein on Toxicity and Structural Mechanism

Liling Zhao, Lei Liu, Zanxia Cao, 2023, Toxins.