SUBDOCK for DOCK6

This repository is a fork of SUBDOCK customized to run with DOCK6 for molecular docking workflows.

Features

• Adapted scripts and configuration for DOCK6 compatibility
• Streamlined input/output handling for DOCK6 jobs
• Example usage and templates for large-scale docking runs

Getting Started

1. Clone the repository:

   git clone https://github.com/yourusername/subdock-dock6.git
   cd subdock-dock6

2. Configure your environment:
   Ensure DOCK6 is installed.

3. Run a docking job:
   See run_docking_example.sh.

Documentation

• See DOCK6 documentation for details on DOCK6 usage.

License

This project inherits the license from the original SUBDOCK repository.

Acknowledgements

• Original SUBDOCK authors
• DOCK6 development team