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Postdoc in Aalto University now; Ph.D of Beijing Institute of Technology; Molecular dynamics; High performance computing.
mdapy. A simple and fast python library to handle the data generated from molecular dynamics simulations
mdapy-tutorial. Jupyter Notebook
lammps_nep. This package aims to provide a simple way to install lammps python interface with NEP support.
mushroomfire.github.io. MyBlog
codon. A high-performance, zero-overhead, extensible Python compiler with built-in NumPy support
polars. Extremely fast Query Engine for DataFrames, written in Rust
JAnim. Programmatic animation engine for creating precise and smooth animations with real-time feedback
miniMD. MiniMD Molecular Dynamics Mini-App
GPUMD. Graphics Processing Units Molecular Dynamics
taichi. Productive, portable, and performant GPU programming in Python.