Metadata-Version: 2.0
Name: murdock
Version: 0.10.5
Summary: A molecular docking framework.
Home-page: http://bitbucket.org/mlichtner/murdock
Author: Malte Lichtner
Author-email: malte.lichtner@googlemail.com
License: Apache 2.0
Keywords: molecular docking development framework
Platform: UNKNOWN
Classifier: Development Status :: 3 - Alpha
Classifier: Intended Audience :: Science/Research
Classifier: Topic :: Scientific/Engineering :: Bio-Informatics
Classifier: License :: OSI Approved :: Apache Software License
Classifier: Programming Language :: Python :: 2.7
Classifier: Programming Language :: Python :: 3.2
Classifier: Programming Language :: Python :: 3.3
Classifier: Programming Language :: Python :: 3.4
Requires-Dist: future (>=0.15)
Requires-Dist: numpy (>=1.6)
Requires-Dist: scipy (>=0.11)
Provides-Extra: html
Requires-Dist: sphinx (>=1.1); extra == 'html'
Provides-Extra: plots
Requires-Dist: matplotlib (>=1.2); extra == 'plots'
Provides-Extra: pymol
Requires-Dist: pymol (>=1.5); extra == 'pymol'

Murdock: A Molecular Docking Framework
======================================

Murdock is a Python package for the development and testing of automated
`molecular docking`_ solutions. It has been developed as a convenient and
efficient platform to implement new search algorithms, scoring functions,
multi-step docking workflows and other features on a reliable platform, test
them quickly and use the rich output to analyse advantages, disadvantages and
issues of a new method. In addition, Murdock comes with a set of end-user
scripts and presets, so that it can be used by anyone solemly to obtain
scientific data, for which only a basic knowledge of command-line tools is
required.

.. _molecular docking: http://en.wikipedia.org/wiki/Docking_(molecular)

.. warning::

    The current Murdock version and (especially) its documentation are at an
    alpha stage. Please make use of one of the `feedback channels`_ to request
    support, ask a questions, comment on the software, report a bug, propose a
    new feature or offer support.

Please refer to the `documentation`_ to get started.

.. _documentation: http://murdock.readthedocs.org/en/latest
.. _feedback channels: http://murdock.readthedocs.org/en/latest/feedback.html


