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GitHub / felix5572 / dpgen

The deep potential generator

JSON API: https://repos.ecosyste.ms/api/v1/hosts/GitHub/repositories/felix5572%2Fdpgen

Fork of deepmodeling/dpgen
Stars: 0
Forks: 1
Open Issues: 0

License: lgpl-3.0
Language: Python
Repo Size: 5.71 MB
Dependencies: 27

Created: about 4 years ago
Updated: 10 months ago
Last pushed: over 2 years ago
Last synced: 10 months ago

Files

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Readme

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Dependencies

.github/workflows/mirror_gitee.yml actions

wearerequired/git-mirror-action v1 composite

.github/workflows/release.yml actions

actions/checkout v2 composite
actions/checkout master composite
felix5572/conda-publish-action v1.9 composite
s-weigand/setup-conda v1 composite
softprops/action-gh-release master composite

.github/workflows/test.yml actions

actions/checkout v2 composite
actions/setup-python v2 composite

doc/requirements.txt pypi

myst-parser ==0.13.7
recommonmark ==0.7.1
sphinx ==3.2.1
sphinx_markdown_tables ==0.0.15
sphinx_rtd_theme ==0.5.2

requirements.txt pypi

ase ==3.17.0
custodian ==2019.2.10
monty ==2.0.4
paramiko ==2.6.0
pymatgen ==2019.6.5

setup.py pypi

GromacsWrapper >=0.8.0
ase *
custodian *
dpdata >=0.1.14
dpdispatcher >=0.3.11
monty >2.0.0
numpy >=1.14.3
paramiko *
pymatgen >=2019.1.13