Pinned Repositories
aenet
Atomic interaction potentials based on artificial neural networks
MyScripts
A folder to store my useful scripts
probability_cheatsheet
A comprehensive 10-page probability cheatsheet that covers a semester's worth of introduction to probability.
zhongxiang117's Repositories
zhongxiang117/probability_cheatsheet
A comprehensive 10-page probability cheatsheet that covers a semester's worth of introduction to probability.
zhongxiang117/MyScripts
A folder to store my useful scripts
zhongxiang117/aenet
Atomic interaction potentials based on artificial neural networks
zhongxiang117/alphafold
Open source code for AlphaFold.
zhongxiang117/codeDump
A folder like its name's description. Kinda of useful, but no one enjoys.
zhongxiang117/confilter
zhongxiang117/deepchem
Democratizing Deep-Learning for Drug Discovery, Quantum Chemistry, Materials Science and Biology
zhongxiang117/DES
Deep eutectic solvent force field parameters (OPLS-DES)
zhongxiang117/GAML
Genetic Algorithm Machine Learning (GAML) software package for automated force field parameterization.
zhongxiang117/IL
Ionic liquid force field parameters (OPLS-2009IL and OPLS-VSIL)
zhongxiang117/jekyll-liquid-debug
zhongxiang117/jekyll-rtd-theme
GitHub-flavored docs theme for Jekyll, based on sphinx_rtd_theme
zhongxiang117/libpme6
C++ implementation of the smooth Particle-Mesh Ewald algorithm for dispersive forces
zhongxiang117/mLJR
This python software automates the calculation of experimentally estimated surface tensions using the Lyderson-Joback-Reid method.
zhongxiang117/openbabel
Open Babel is a chemical toolbox designed to speak the many languages of chemical data.
zhongxiang117/packmol
Packmol
zhongxiang117/plumed2
Development version of plumed 2
zhongxiang117/PyAutoDock
The Python Codes Refactoring for AutoDock program
zhongxiang117/pyBOSS
pyBOSS software package for calculating chemical reactions in solution.
zhongxiang117/pyenv
Simple Python version management
zhongxiang117/PyRandLib
Many best in class pseudo random generators grouped into one simple library.
zhongxiang117/schnetpack
SchNetPack - Deep Neural Networks for Atomistic Systems
zhongxiang117/Writings
A folder for interests
zhongxiang117/zhongxiang117.github.io