【期刊论文】Thermodynamic integration calculations of bingding free energy difference for Gly-169 mutation in subtilisin BPN`
王存新
【期刊论文】A Soft Docking Algorithm for Predicting the Structure of Antibody-Antigen Complexes
王存新
【期刊论文】Investigating interactions between HIV-1 gp41 and inhibitors by molecular dynamics simulationand MM-PBSA/GBSA calculations
王存新
【期刊论文】Analysis of friction kernels for n-butane isomerization in water by the generalized Langevin equation
王存新
【期刊论文】Fractal study of tertiary structure of proteins
王存新
【期刊论文】Analysis of interfacial water structure and dynamics in α-maltose solution by molecular dynamics simulation
王存新
【期刊论文】Constructing HIV-1 integrase tetramer and exploring influences of metal ions on forming integrase-DNA complex
王存新
【期刊论文】Molecular dynamics simulations of the gramicidin A-dimyristoylphosphatidylcholine system with an ion in the channel pore region
王存新
【期刊论文】Prediction of the binding mode between BMS-378806 and HIV-1 gp120 by docking and molecular dynamics simulation
王存新
【期刊论文】Incorporating Hydration Force Determined by Boundary Element Method into Stochastic Dynamics
王存新
【期刊论文】A Stochastic Dynamics Simulation Study Associated with Hydration Force and Friction Memory Effect
王存新
【期刊论文】A protein-protein docking algorithm dependent on the type of complexes
王存新
【期刊论文】Protein Molecular Dynamics With Electrostatic Force Entirely Determined by a Single Poisson-Boltzmann Calculation
王存新
【期刊论文】Investigating the dielectric effects of channel pore water on the electrostatic barriers of the permeation ion by the finite difference Possion-Boltzmann method
王存新
【期刊论文】Analysis of Domain Movements in Glutamine-Bingding Protein with Simple Models
王存新
【期刊论文】Exploring binding mode for styrylquinoline HIV-1 integrase inhibitors using comparative molecular field analysis and docking studies
王存新
【期刊论文】Protein design based on the relative entropy
王存新
【期刊论文】Biologically Enhanced Sampling Geometric Docking and Backbone Flexibility Treatment With Multiconformational Superposition
王存新
【期刊论文】Docking dinucleotides to HIV-1 integrase carboxyl-terminal domain to find possible DNA binding sites
王存新
【期刊论文】A new computational approach for real protein folding prediction