pikachu's repositories
acpype
OFFICIAL: AnteChamber PYthon Parser interfacE
blender-learning
learning blender, create my own blender files
cgcnn
Crystal graph convolutional neural networks for predicting material properties.
cp2k
Quantum chemistry and solid state physics software package
deeptime
Python library for analysis of time series data including dimensionality reduction, clustering, and Markov model estimation
DFT-EXERCISES
DENSITY FUNCTIONAL THEORY EXERCISES
espresso
The ESPResSo package
feasst
The Free Energy and Advanced Sampling Simulation Toolkit (FEASST) is a free, open-source, modular program to conduct molecular and particle-based simulations with flat-histogram Monte Carlo and molecular dynamics methods.
graphtime
Encoding of transition probabilities with undirected graphical models
KymoKnot
A software package to identify and locate knots in polymers
logic_vsi
牛津通识读本 Logic: A Very Short Introduction 新译本（补充了第2版新增的两章）
mdanalysis
MDAnalysis is a Python library to analyze molecular dynamics simulations.
msmrd
MSMs coupled with reaction-diffusion dynamics
Paddle
PArallel Distributed Deep LEarning
PatchyParticles
A tutorial code to perform Monte Carlo simulations of patchy particles
ProgrammingProjects
C++ Programming Tutorial in Chemistry
pscf
Polymer self-consistent field theory
pyplot-fortran
For generating plots from Fortran using Python's matplotlib.pyplot 📈
readdy
Python / C++ based particle reaction-diffusion simulator
SciFortran
A library of fortran modules and routines for scientific calculations (*in a way* just like scipy for python)
shadowsocks-qt5
A cross-platform shadowsocks GUI client
simpatico
Molecular dynamics and Monte Carlo simulation package for polymeric and molecular liquids
SSAGES-public
Public release of SSAGES
tfprobability
R interface to TensorFlow Probability
wsxq2.github.io
the date 2019-07-07 in _posts