Pinned Repositories
abiflows
High-throughput calculations with Abinit
ase-espresso
ase interface for Quantum Espresso
atomate
atomate is a powerful software for computational materials science and contains pre-built workflows.
book-1
book
bookshelf
:books: books
cgcnn
Crystal graph convolutional neural networks for predicting material properties.
deeplearningbook-chinese
Deep Learning Book Chinese Translation
keras-molecules
Autoencoder network for learning a continuous representation of molecular structures.
mapidoc
Public repo for Materials API documentation
ml4chem
ML4Chem: Machine Learning for Chemistry and Materials
FuzhuLiu's Repositories
FuzhuLiu/abiflows
High-throughput calculations with Abinit
FuzhuLiu/ase-espresso
ase interface for Quantum Espresso
FuzhuLiu/atomate
atomate is a powerful software for computational materials science and contains pre-built workflows.
FuzhuLiu/book-1
book
FuzhuLiu/bookshelf
:books: books
FuzhuLiu/cgcnn
Crystal graph convolutional neural networks for predicting material properties.
FuzhuLiu/deeplearningbook-chinese
Deep Learning Book Chinese Translation
FuzhuLiu/keras-molecules
Autoencoder network for learning a continuous representation of molecular structures.
FuzhuLiu/mapidoc
Public repo for Materials API documentation
FuzhuLiu/ml4chem
ML4Chem: Machine Learning for Chemistry and Materials
FuzhuLiu/node2vec
Implementation of the node2vec algorithm.
FuzhuLiu/SISSO
A data-driven method based on compressed-sensing for identifying descriptors for materials properties and functions
FuzhuLiu/sumo
Heavyweight plotting tools for ab initio calculations
FuzhuLiu/tpot
A Python Automated Machine Learning tool that optimizes machine learning pipelines using genetic programming.
FuzhuLiu/vasp
New ASE compliant Python interface to VASP
FuzhuLiu/VASPy
Manipulating VASP files with Python.
FuzhuLiu/ZY-Player
Video player made by electron and Vue