2024
Clustering one million molecular structures on GPU within seconds.
J. Comput. Chem., December, 2024

2023
SurfPB: A GPU-Accelerated Electrostatic Calculation and Visualization Tool for Biomolecules.
J. Chem. Inf. Model., August, 2023

Enhanced sampling in explicit solvent by deep learning module in FSATOOL.
J. Comput. Chem., 2023

Front Cover.
J. Comput. Chem., 2023

2022
FSATOOL 2.0: An integrated molecular dynamics simulation and trajectory data analysis program.
J. Comput. Chem., 2022