Materials Design by Monte Carlo Tree Search
python >= 2.7.x
numpy >=1.12.x
COMBO https://github.com/tsudalab/combo
Complete documentation is here
Download or clone the github repository, e.g. git clone https://github.com/tsudalab/MDTS
CD to the MDTS folder
python setup.py install
Please refer to test.py file for usage
If you use this package, please cite us:
Thaer M. Dieb, Shenghong Ju, Kazuki Yoshizoe, Zhufeng Hou, Junichiro Shiomi and Koji Tsuda, MDTS: Automatic Complex Materials Design using Monte Carlo Tree Search, Science and Technology of Advanced Materials, Vol. 18, Iss. 1, 2017