ewijaya/cluspro-automation-py: Automated protein-protein docking pipeline for ClusPro. Batch submission, queue monitoring, results parsing, and GPCR topology-aware pose validation. Enables high-throughput virtual screening of peptide-receptor interactions for drug discovery workflows. (opens in new tab)

Automated protein-protein docking pipeline for ClusPro. Batch submission, queue monitoring, results parsing, and GPCR topology-aware pose validation. Enables high-throughput virtual screening of pe...