Budiwan Sumarsono

Agentic AI-Orchestrated Computational Drug Discovery: A Case-Study-Demonstrated Open-Source Workflow Blueprint

Bringing a new drug to market can exceed $1 billion, and integrated commercial computational-chemistry platforms cost $200,000–$5,000,000 per year, placing them beyond most resource-constrained research groups. We demonstrate that open-source tools with large language model (LLM) orchestration can democratize early-sta...