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abipy

Open-source library for analyzing the results produced by ABINIT

cgcnn

Crystal graph convolutional neural networks for predicting material properties.

cheatsheets-ai

Essential Cheat Sheets for deep learning and machine learning researchers

crystagraphnn

garnet

maml

Python for Materials Machine Learning, Materials Descriptors, Machine Learning Force Fields, Deep Learning, etc.

mlchempapers

A sorted list of ML (mostly deep learning) papers relating to chemistry, biology, and drug discovery.

my_util

pymatgen

Python Materials Genomics (pymatgen) is a robust materials analysis code that defines core object representations for structures and molecules with support for many electronic structure codes. It is currently the core analysis code powering the Materials Project.

resume

An elegant \LaTeX\ résumé template