DOCK 3.8:How to install pydock3
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 tarball.
2. Download the tarball.
3. Install pydock3 to your Python:
pip install <NAME_OF_TARBALL>.tar.gz
Note: requires Python>=3.8