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packmol-step

2024.7.25

packmol_step-2024.7.25-py2.py3-none-any.whl

Wheel Details

Project:	packmol-step
Version:	2024.7.25
Filename:	packmol_step-2024.7.25-py2.py3-none-any.whl
Download:	[link]
Size:	24654
MD5:	`6fe73b576e9446017c652eb0b41f1575`
SHA256:	`ddc6895ae2b71cf0d10c14875ad6c57214d8066ebd19ed59a44441e00f922afc`
Uploaded:	2024-07-25 19:10:39 +0000

dist-info

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

METADATA

Metadata-Version:	2.1
Name:	packmol_step
Version:	2024.7.25
Summary:	A SEAMM plug-in for building periodic boxes of fluid using Packmol
Author:	Paul Saxe
Author-Email:	psaxe[at]molssi.org
Home-Page:	https://github.com/molssi-seam/packmol_step
License:	BSD-3-Clause
Keywords:	SEAMM,plug-in,flowchart,Packmol,fluid,molecules
Classifier:	Development Status :: 5 - Production/Stable
Classifier:	Intended Audience :: Science/Research
Classifier:	License :: OSI Approved :: BSD License
Classifier:	Natural Language :: English
Classifier:	Programming Language :: Python :: 3 :: Only
Classifier:	Programming Language :: Python :: 3.7
Classifier:	Programming Language :: Python :: 3.8
Platform:	Linux
Platform:	Mac OS-X
Platform:	Unix
Platform:	Windows
Requires-Dist:	seamm
Requires-Dist:	tabulate
Description-Content-Type:	text/x-rst
License-File:	LICENSE
License-File:	AUTHORS.rst

[Description omitted; length: 6607 characters]

WHEEL

Wheel-Version:	1.0
Generator:	setuptools (71.1.0)
Root-Is-Purelib:	true
Tag:	py2-none-any
Tag:	py3-none-any

RECORD

Path	Digest	Size
packmol_step/__init__.py	sha256=x_HAXPUOD8lITVA6_bvb4WWJZgw1G4eFaYS7Y9C3Hx0	689
packmol_step/__main__.py	sha256=K93JmIrRSKhPPu7JJUNEMr-cx5fvmft20QR_rGAjiww	496
packmol_step/_version.py	sha256=MdhRF4pnyPxiOfqW2G_uV9iLbw9kp2KVvxEbV79pcR0	501
packmol_step/installer.py	sha256=VNWcexqw8Ic75EQrStIQ88sb0TX_hZtSMDoSgjrtpj0	8722
packmol_step/packmol.py	sha256=YsX8FEP1ULnCE3Ttq1ff7rAKyuGfUz4nWirgMzRVwFQ	37257
packmol_step/packmol_parameters.py	sha256=QT_JuzR03jN5rHcvkZqyVw2tDDGybNVvKBKZ9mrIQ_Y	8983
packmol_step/packmol_step.py	sha256=FH5cG5vPj1kMAuv93q-DFKx8TkVpMJA28bR_1eawwyU	1151
packmol_step/tk_packmol.py	sha256=6_ID5chlRSBOojp6WApyvXVSfyRNalpCFRPb1wdddoY	13897
packmol_step/data/configuration.txt	sha256=vo5Nyr930UxDK0ux3Yo0nCrJNLNBhwJkfNNXONH1Bq4	82
packmol_step/data/packmol.ini	sha256=Rq34wvbC3r7ppOtQ7OB7iRe9IlIMxe0o3bdgUk71LPc	2507
packmol_step/data/references.bib	sha256=73vvWAFHsJz3SK7XyBZrUyxbKoAJt7t-bfLpVmHIGQM	944
packmol_step/data/seamm-packmol.yml	sha256=Nm2qC7_IxEfximoBSIX7ciA4ebGvM-rS-s5TC4NyToc	107
packmol_step-2024.7.25.dist-info/AUTHORS.rst	sha256=HKy1QAUcENUPZZIAeLClJTLLQ0m438MWROo7bvLs41Q	126
packmol_step-2024.7.25.dist-info/LICENSE	sha256=QXQ5GPzXg-8OZ_sumdjjTQN04XC48bpOBqoyRd3k8Zo	1509
packmol_step-2024.7.25.dist-info/METADATA	sha256=pGee8iIFtmWHwfXk1hq3riBpGoyJvAH0AsiiMrU4DZw	7479
packmol_step-2024.7.25.dist-info/WHEEL	sha256=ANi2y8tYx-p70pj7MSdqQMJNFJEUgAOyfPpHzqz0w84	109
packmol_step-2024.7.25.dist-info/entry_points.txt	sha256=l8b1KKpbt7ISyMk3E_0SR3OlyUnIx8wuGTuLtDLsVx4	182
packmol_step-2024.7.25.dist-info/top_level.txt	sha256=xHvZvPdid_AmsX8YTUNFsmdboxR6iJN53dIg1uiV0E4	13
packmol_step-2024.7.25.dist-info/zip-safe	sha256=AbpHGcgLb-kRsJGnwFEktk7uzpZOCcBY74-YBdrKVGs	1
packmol_step-2024.7.25.dist-info/RECORD	—	—

top_level.txt

packmol_step

entry_points.txt

[console_scripts]

packmol-step-installer = packmol_step.__main__:run

[org.molssi.seamm]

Packmol = packmol_step:PackmolStep

[org.molssi.seamm.tk]

Packmol = packmol_step:PackmolStep