Wei Yang

10PUBLICATIONS
38CO-AUTHORS
Characterisation of biological macromoleculesBioinformatic methods developmentBiomolecular modelling and designStatistical mechanics in chemistryComputational chemistry
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Publications (10)

|Jan 02, 2026
An accurate and efficient NPT ensemble molecular dynamics simulation method.

Zilin Huang, Lianqing Zheng, Wei Yang

|Jun 16, 2025
A Gaussian kernel Monte Carlo resampling method to construct smooth free energy surface from discrete simulation data.

Xubin Li, Tianming Qu, Lianqing Zheng

|Mar 11, 2025
ABCG2: A Milestone Charge Model for Accurate Solvation Free Energy Calculation.

Xibing He, Viet H Man, Wei Yang

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