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nequip

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0.6.0 nequip-0.6.0-py3-none-any.whl

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Project: nequip
Version: 0.6.0
Filename: nequip-0.6.0-py3-none-any.whl
Download: [link]
Size: 172632
MD5: e1ebd18167044629536771700cf51fd1
SHA256: 5b642b9e9bb651e4647a2e1a28395f36fa6c93587a03de9f3f1d8d849616ec45
Uploaded: 2024-05-10 22:28:05 +0000

dist-info

METADATA · WHEEL · RECORD · top_level.txt · entry_points.txt · zip-safe

METADATA

Metadata-Version: 2.1
Name: nequip
Version: 0.6.0
Summary: NequIP is an open-source code for building E(3)-equivariant interatomic potentials.
Author: Simon Batzner, Albert Musealian, Lixin Sun, Anders Johansson, Mario Geiger, Tess Smidt
Download-Url: https://github.com/mir-group/nequip
Requires-Python: >=3.7
Requires-Dist: numpy
Requires-Dist: ase
Requires-Dist: tqdm
Requires-Dist: e3nn (<0.6.0,>=0.4.4)
Requires-Dist: pyyaml
Requires-Dist: torch-runstats (>=0.2.0)
Requires-Dist: torch-ema (>=0.3.0)
Requires-Dist: contextlib2; python_version < "3.7"
Requires-Dist: contextvars; python_version < "3.7"
Requires-Dist: typing-extensions; python_version < "3.8"
[No description]

WHEEL

Wheel-Version: 1.0
Generator: bdist_wheel (0.43.0)
Root-Is-Purelib: true
Tag: py3-none-any

RECORD

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nequip-0.6.0.dist-info/RECORD — —

top_level.txt

nequip

entry_points.txt

[console_scripts]
nequip-benchmark = nequip.scripts.benchmark:main
nequip-deploy = nequip.scripts.deploy:main
nequip-evaluate = nequip.scripts.evaluate:main
nequip-train = nequip.scripts.train:main

zip-safe