{ "info": { "author": "Carl Simon Adorf", "author_email": "csadorf@umich.edu", "bugtrack_url": null, "classifiers": [ "Development Status :: 2 - Pre-Alpha", "Intended Audience :: Developers", "License :: OSI Approved :: MIT License", "Natural Language :: English", "Programming Language :: Python :: 3", "Programming Language :: Python :: 3.4", "Programming Language :: Python :: 3.5", "Programming Language :: Python :: 3.6", "Programming Language :: Python :: 3.7" ], "description": "==============================================\nFourier-filtered Relative Entropy Minimization\n==============================================\n\n\n.. image:: https://img.shields.io/pypi/v/ff-rem.svg\n :target: https://pypi.python.org/pypi/ff-rem\n\n.. image:: https://readthedocs.org/projects/ff-rem/badge/?version=latest\n :target: https://ff-rem.readthedocs.io/en/latest/?badge=latest\n :alt: Documentation Status\n\n\nImplementation of the Fourier-filtered Entropy Minimization (FF-REM) method for HOOMD-blue.\nThe method is described in detail in the associated publication:\n\n Carl S. Adorf, James Antonaglia, Julia Dshemuchadse, Sharon C. Glotzer, 2018. DOI: `10.1063/1.5063802 `_.\n\n* Free software: MIT license\n* Documentation: https://ff-rem.readthedocs.io.\n\nQuickstart\n----------\n\nA complete example for the recovery of a Lennard-Jones potential is shown in ``examples/lennard-jones``.\n\n\nRequirements\n------------\n\n* numpy\n* HOOMD-blue\n* gsd\n\nTesting\n-------\n\nTo execute unit tests, run:\n\n.. code-block:: bash\n\n $ python -m unittest discover tests/\n\nwithin the package root directory.\n\nCredits\n-------\n\nThis package was created with Cookiecutter_ and the `audreyr/cookiecutter-pypackage`_ project template.\n\n.. _Cookiecutter: https://github.com/audreyr/cookiecutter\n.. _`audreyr/cookiecutter-pypackage`: https://github.com/audreyr/cookiecutter-pypackage\n\n\n=======\nHistory\n=======\n\n0.1.0 (2018-10-17)\n------------------\n\n* First release on PyPI.\n\n\n", "description_content_type": "", "docs_url": null, "download_url": "", "downloads": { "last_day": -1, "last_month": -1, "last_week": -1 }, "home_page": "https://bitbucket.org/glotzer/ff-rem", "keywords": "FF-REM", "license": "MIT license", "maintainer": "", "maintainer_email": "", "name": "ff-rem", "package_url": "https://pypi.org/project/ff-rem/", "platform": "", "project_url": "https://pypi.org/project/ff-rem/", "project_urls": { "Homepage": "https://bitbucket.org/glotzer/ff-rem" }, "release_url": "https://pypi.org/project/ff-rem/0.1.0/", "requires_dist": [ "Click (>=6.0)" ], "requires_python": "", "summary": "Implementation of FF-REM for HOOMD-blue.", "version": "0.1.0" }, "last_serial": 4919323, "releases": { "0.1.0": [ { "comment_text": "", "digests": { "md5": "1fbe29652982ca2a3316bee84b76e4d0", "sha256": "fc022aec3ba19e6810f574650858589bfba770ff154548dbc5bed07fe6c6844e" }, "downloads": -1, "filename": "ff_rem-0.1.0-py2.py3-none-any.whl", "has_sig": false, "md5_digest": "1fbe29652982ca2a3316bee84b76e4d0", "packagetype": "bdist_wheel", "python_version": "py2.py3", "requires_python": null, "size": 7741, "upload_time": "2018-11-27T23:16:17", "url": "https://files.pythonhosted.org/packages/71/5b/40e952516d7bc691fa9f83b6c0577bbfb756eaf458cfb2108bbf0e6f28b5/ff_rem-0.1.0-py2.py3-none-any.whl" } ] }, "urls": [ { "comment_text": "", "digests": { "md5": "1fbe29652982ca2a3316bee84b76e4d0", "sha256": "fc022aec3ba19e6810f574650858589bfba770ff154548dbc5bed07fe6c6844e" }, "downloads": -1, "filename": "ff_rem-0.1.0-py2.py3-none-any.whl", "has_sig": false, "md5_digest": "1fbe29652982ca2a3316bee84b76e4d0", "packagetype": "bdist_wheel", "python_version": "py2.py3", "requires_python": null, "size": 7741, "upload_time": "2018-11-27T23:16:17", "url": "https://files.pythonhosted.org/packages/71/5b/40e952516d7bc691fa9f83b6c0577bbfb756eaf458cfb2108bbf0e6f28b5/ff_rem-0.1.0-py2.py3-none-any.whl" } ] }