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Author:
Leandro Seixas Rocha
Summary:
quasigraph: Chemical and Geometric Descriptor Toolkit for Machine Learning Models.
Latest version:
26.10.1
Required dependencies:
ase
|
numpy
|
pandas
|
vesin
Optional dependencies:
mendeleev
|
mypy
|
networkx
|
pymatgen
|
pytest
|
ruff
|
scikit-learn
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