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Author:
DeepModeling
Summary:
Manipulating data formats of DeePMD-kit, VASP, QE, PWmat, and LAMMPS, etc.
Latest version:
1.0.2
Required dependencies:
h5py
|
lmdb
|
monty
|
msgpack-numpy
|
numpy
|
scipy
|
wcmatch
Optional dependencies:
ase
|
deepmodeling-sphinx
|
jupyterlite-sphinx
|
jupyterlite-xeus
|
myst-parser
|
numpydoc
|
parmed
|
pymatgen
|
pytest
|
pytest-codspeed
|
rdkit
|
recommonmark
|
sphinx
|
sphinx-argparse
|
sphinx-book-theme
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