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.
Please refer to the documentation to get started.
Release history Release notifications | RSS feed
Download the file for your platform. If you're not sure which to choose, learn more about installing packages.
Hashes for murdock-0.10.6-py2.py3-none-any.whl