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mgltools-pyautodock

Python implementation of autodock

This package is part of the mgltools set of Python libraries which provide an infrastructure for the analysis of protein structures and their docking of chemical compounds. This package provides a Python implementation of the autodock3 scoring function and of the new autodock4 scoring function. Also it includes a Python implementation of AutoGrid.

AutoDock is a well established package for the automated screening of libraries of formal representation of chemical compounds that putatively bind to a particular protein at hand. This package provides a graphical user interface that is helping with the preparation of the protein for such analyses.

Homepage:
Package version:1.5.6~rc3~cvs.20120206-1
Architecture:all
Distribution:Debian
Filename:mgltools-pyautodock_1.5.6~rc3~cvs.20120206-1_all.deb

/usr/share/doc/mgltools-pyautodock/README.Debian

autodocktools and other modules of MGLtools for Debian
======================================================

This package aims at providing the complete infrastructure for ligand
screening with Debian Linux.  It is part of the MGL (Molecular Graphics
Labs at Scripps) Python tools set for the computational and visual
interaction of protein structures and their ligands.

The Debian community shall
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/usr/share/doc/mgltools-pyautodock/changelog.Debian.gz

mgltools-pyautodock (1.5.6~rc3~cvs.20120206-1) unstable; urgency=low

  * New upstream version.
  * debian/control: vcs fields corrected

 -- Thorsten Alteholz <debian@alteholz.de>  Mon, 06 Feb 2012 18:00:00 +0100

mgltools-pyautodock (1.5.6~rc2+cvs.20111222-1) unstable; urgency=low

  * New upstream version.

 -- Steffen Moeller <moeller@debian.org>  Thu, 22 Dec 2011 17:10:10 +0100

mgltools-pyau
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/usr/share/pyshared/PyAutoDock/LICENSE

This software is copyrighted by Michel F. Sanner (sanner@scripps.edu) and TSRI.
The following terms apply to all files associated with the software 
unless explicitly disclaimed in individual files.

       MGLTOOLS SOFTWARE LICENSE AGREEMENT.

  1. Grant Of Limited License; Software Use Restrictions. The programs
     received by you will be used only for NON COMMERCIAL purposes.
     This licens
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/usr/share/doc/mgltools-pyautodock/copyright

This package was debianized by Steffen Moeller <moeller@debian.org> on
Thu, 10 Jul 2008 00:03:24 +02
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