DOCK 3.8:How to install pydock3

From DISI
Revision as of 07:31, 2 September 2022 by Ianscottknight (talk | contribs)
Jump to navigation Jump to search

pydock3 is a Python package wrapping the DOCK Fortran program that provides tools to help standardize and automate the computational methods employed in molecular docking.

Installation instructions: 1. Email John Irwin or Ian Scott Knight asking for access to the pydock3 wheel binary. 2. Download the wheel binary. 3. Install pydock3 to your Python: 

pip install <NAME_OF_WHEEL_FILE>.whl

Note: requires Python>=3.8

Retrieved from "http://wiki.docking.org/index.php?title=DOCK_3.8:How_to_install_pydock3&oldid=14739"