/ppdx

Build protein-protein complexes and compute binding descriptors

Primary LanguagePythonGNU General Public License v3.0GPL-3.0

ppdx

Build protein-protein complexes and compute binding descriptors.

Install

  1. Install ppdx with pip: pip install --user --upgrade python/ or run install.sh

  2. Install modeller from their website

  3. Install CHARMM and get a copy of the CHARMM force field

  4. Install optional dependences. See config-ppdx.ini in example directories.

Usage

See the example directories.