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MDPOW

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0.9.0 MDPOW-0.9.0-py3-none-any.whl

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Project: MDPOW
Version: 0.9.0
Filename: MDPOW-0.9.0-py3-none-any.whl
Download: [link]
Size: 3323751
MD5: 14c47c7c13648534686d67b815db9154
SHA256: 140a276298c013eaf7477d963e5f2e49819fa120fdc4a5e1fdaac1edd7b04bf0
Uploaded: 2024-10-11 16:29:56 +0000

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

METADATA

Metadata-Version: 2.1
Name: MDPOW
Version: 0.9.0
Summary: A library for computing solvation/water partitioning coefficients using molecular dynamics simulations
Author: Oliver Beckstein
Author-Email: orbeckst[at]gmail.com
Home-Page: https://github.com/Becksteinlab/MDPOW
License: GPLv3
Keywords: science Gromacs analysis 'molecular dynamics'
Classifier: Development Status :: 4 - Beta
Classifier: Environment :: Console
Classifier: Intended Audience :: Science/Research
Classifier: License :: OSI Approved :: GNU General Public License v3 or later (GPLv3+)
Classifier: Operating System :: POSIX
Classifier: Operating System :: MacOS :: MacOS X
Classifier: Programming Language :: Python
Classifier: Programming Language :: Python :: 3
Classifier: Programming Language :: Python :: 3.10
Classifier: Programming Language :: Python :: 3.11
Classifier: Programming Language :: Python :: 3.12
Classifier: Topic :: Scientific/Engineering :: Chemistry
Classifier: Topic :: Scientific/Engineering :: Physics
Requires-Dist: numpy (>=1.6)
Requires-Dist: scipy (>=1.11.0)
Requires-Dist: pyyaml
Requires-Dist: GromacsWrapper (>=0.5.1)
Requires-Dist: numkit
Requires-Dist: six
Requires-Dist: mdanalysis (>=2)
Requires-Dist: alchemlyb (>=2)
Requires-Dist: pandas
Requires-Dist: pymbar (>=4)
Requires-Dist: matplotlib
Requires-Dist: seaborn
Requires-Dist: rdkit
Requires-Dist: svgutils
Requires-Dist: cairosvg
Requires-Dist: pypdf
Description-Content-Type: text/x-rst
License-File: COPYING
License-File: AUTHORS
[Description omitted; length: 3497 characters]

WHEEL

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

RECORD

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top_level.txt

mdpow

zip-safe