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Author:
Alin M Elena
Summary:
A Python package for processing omol-25 data using MPI.
Latest version:
0.2.4
Required dependencies:
altair
|
ase
|
boto3
|
fastparquet
|
h5py
|
janus-core
|
lmdb
|
mace-torch
|
matplotlib
|
mpi4py
|
orjson
|
pandas
|
pyarrow
|
pyyaml
|
scikit-learn
|
tqdm
|
zstandard
Optional dependencies:
pre-commit
|
pytest-cov
|
sphinx
|
sphinx-material
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