README.rst

Autodock scipion plugin

Documentation under development, sorry for the inconvenience

Scipion framework plugin for the use of tools provided by Autodock software suite.

Full documentation to this plugin can be found in the official documentation page.

Install this plugin

You will need to use 3.0.0 version of Scipion to run these protocols. To install the plugin, you have two options:

• Stable version

scipion installp -p scipion-chem-autodock

OR

• through the plugin manager GUI by launching Scipion and following Configuration >> Plugins

• Developer's version

1. Download repository:

git clone https://github.com/scipion-chem/scipion-chem-autodock.git

2. Switch to the desired branch (master or devel):

Scipion-chem-autodock is constantly under development. If you want a relatively older an more stable version, use master branch (default). If you want the latest changes and developments, user devel branch.

cd scipion-chem-autodock
git checkout devel

3. Install:

scipion installp -p path_to_scipion-chem-autodock --devel

• Binary files

Atom_struct_utils plugin is a pure Python module, no binary files are required.

• Tests

To check the installation, simply run the following Scipion test:

Buildbot status

Status devel version:

Status production version: