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1.0.0 aidsorb-1.0.0-py3-none-any.whl

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Project: aidsorb
Version: 1.0.0
Filename: aidsorb-1.0.0-py3-none-any.whl
Download: [link]
Size: 79475
MD5: 353db23bd30a7aa2601e0bc3092eba36
SHA256: ea174f12512c15e88a1e0ee3286b06fb5b3ecffe15ba0725f7bcbd5012718c81
Uploaded: 2024-10-02 14:14:53 +0000

dist-info

METADATA · WHEEL · RECORD · top_level.txt · entry_points.txt

METADATA

Metadata-Version: 2.1
Name: aidsorb
Version: 1.0.0
Summary: Python package for deep learning on molecular point clouds.
Author-Email: "Antonios P. Sarikas" <antonios.sarikas[at]gmail.com>
Project-Url: Homepage, https://github.com/adosar/aidsorb
Project-Url: Issues, https://github.com/adosar/aidsorb/issues
Project-Url: Documentation, https://aidsorb.readthedocs.io/en/stable/
License: GPL-3.0-only
Classifier: Programming Language :: Python :: 3
Classifier: License :: OSI Approved :: GNU General Public License v3 (GPLv3)
Classifier: Operating System :: POSIX :: Linux
Requires-Python: >=3.11
Requires-Dist: ase (>=3.22.1)
Requires-Dist: fire (>=0.5.0)
Requires-Dist: plotly (>=5.19.0)
Requires-Dist: tqdm (>=4.66.2)
Requires-Dist: pandas (>=2.2.0)
Requires-Dist: scipy (>=1.12.0)
Requires-Dist: lightning (>=2.2.1)
Requires-Dist: jsonargparse[signatures] (>=4.27.7)
Requires-Dist: numpy (<=1.26.4)
Description-Content-Type: text/markdown
License-File: LICENSE
[Description omitted; length: 4689 characters]

WHEEL

Wheel-Version: 1.0
Generator: setuptools (75.1.0)
Root-Is-Purelib: true
Tag: py3-none-any

RECORD

Path Digest Size
aidsorb/__init__.py sha256=79YduINaGDd1hFTiDjKNDjQh3qHlqs3kenZd9LPuixs 1426
aidsorb/_cli.py sha256=NkH9K5U4Rc0C18XluyusxWjqw8rO_rcvcBowTS1YIlY 1392
aidsorb/_internal.py sha256=fqiFcvxgkRW7b5in-dHyBpZ4S-Ux2iptmukeU9fJM8U 2049
aidsorb/data.py sha256=wcWFmWxl-2PGZKOA1mMqWIbEOygudaY6da1rbIehvOo 13630
aidsorb/datamodules.py sha256=nOy7c-LbmzofZ9h5MvHRWg5FEdNdf-VqLi0Xk6sb9R4 8740
aidsorb/litmodels.py sha256=00a2lx61ayg_rGHocCjCxvO8ayQIU9UjXnyTnzcYcq4 6028
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aidsorb/transforms.py sha256=nDxt1RP3GbfPdNLkV4PPvNMVaEGT3PeKezpzNe-BQQ8 6786
aidsorb/utils.py sha256=t5wqW3gYt4SuQEp1GUGFGp_2g8VerFBD1YtdW6Ev0Ag 6183
aidsorb/visualize.py sha256=N0fjKFlnDfmgwsSFLK8ncmNqL_BTarm0Of5yXkUi58w 5084
aidsorb/pkg_data/README.md sha256=oWoC5u_KXSdXIjLE-qt78SoPsFCPaPNh5mu9HExZ9PA 53
aidsorb/pkg_data/periodic_table.csv sha256=XX8_7SHpR92e1w0ExsRtIBI6Tp8JuKX3Qyow-u5ZsRI 111371
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aidsorb-1.0.0.dist-info/top_level.txt sha256=RMgDEqSPxDbLIhGKNxCT3-xjnzDLjN_q4YVDBfuFbKw 8
aidsorb-1.0.0.dist-info/RECORD — —

top_level.txt

aidsorb

entry_points.txt

[console_scripts]
aidsorb = aidsorb._cli:aidsorb_fire
aidsorb-lit = aidsorb._cli:lightning_cli