Autodock plugin: Difference between revisions

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== Installation ==
== Installation ==
The plugin is now automatically available in the project Pymol-script-repo.<br>
It is available only with the the Vina executable, since it has been found that Vina is
orders of magnitudes faster than Autodock4.


# Download [http://wwwuser.gwdg.de/~dseelig/adplugin.html plugin]
# Download [http://wwwuser.gwdg.de/~dseelig/adplugin.html plugin]

Revision as of 11:04, 4 December 2011

Description

This plugin should help to set up docking runs with Autodock and view docking results. It has two features:

  1. Setup of a docking grid for Autodock with PyMOL.
  2. View the docking results.

Installation

The plugin is now automatically available in the project Pymol-script-repo.
It is available only with the the Vina executable, since it has been found that Vina is orders of magnitudes faster than Autodock4.

  1. Download plugin
  2. PyMOL > Plugin > Install Plugin
  3. MGLTools/AutoDockTools
  4. AutoDock4.2
  5. AutoDock Vina

Tutorial Video

Watch Dan Seeliger's autodock plugin tutorial.

Author

Daniel Seeliger

Python Code

Download: plugins/autodock_plugin.py
This code has been put under version control in the project Pymol-script-repo