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Build protein-protein complexes and compute binding descriptors

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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.

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Build protein-protein complexes and compute binding descriptors

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