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Author:
Jiayan Xu
License:
GNU GENERAL PUBLIC LICENSE
Version 3, 29 June 2007
Copyright (C) 2007 Free Software Foundation, Inc. <https://fsf.org/>
Everyone is permitted ...
Summary:
Automate computational chemistry/materials sciance and machine learning interatomic potential training workflow.
Latest version:
0.0.11
Required dependencies:
ase
|
h5py
|
joblib
|
networkx
|
omegaconf
|
pyyaml
|
tinydb
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