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deep-learning-from-scratch icon deep-learning-from-scratch

《深度学习入门-基于Python的理论与实现》，包含源代码和高清PDF(带书签)；慕课网imooc《深度学习之神经网络(CNN-RNN-GAN)算法原理-实战》；《菜菜的机器学习sklearn》

hea_ml- icon hea_ml-

High-Entropy Alloy (Al-Fe-Co-Cr-Ni) Design Combined with First-Principles Calculation and Machine Learning

mapidoc icon mapidoc

Public repo for Materials API documentation

matminer_examples icon matminer_examples

A repo of examples for the matminer (https://github.com/hackingmaterials/matminer) code

megnet-- icon megnet--

（预测晶体结构）Graph Networks as a Universal Machine Learning Framework for Molecules and Crystals

pyautogui icon pyautogui

A cross-platform GUI automation Python module for human beings. Used to programmatically control the mouse & keyboard.

pydata-book icon pydata-book

Materials and IPython notebooks for "Python for Data Analysis" by Wes McKinney, published by O'Reilly Media

pyml icon pyml

Python and Machine Learning Course

sklearn-ml icon sklearn-ml

各种机器学习方法在sklearn中的使用-菜菜的机器学习sklearn课堂

vasp_poscar_methods icon vasp_poscar_methods

Assorted methods for modifying VASP structure files (POSCAR or CONTCAR). Most methods pertain to modifying selective dynamics conditions or manipulating the structure itself.

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