MMORF: A Multi-agent Framework for Designing Multi-objective Retrosynthesis Planning Systems
Multi-objective retrosynthesis planning is a critical chemistry task requiring dynamic balancing of quality, safety, and cost objectives. Language model-based multi-agent systems (MAS) offer a promising approach for this task: leveraging interactions of specialized agents to incorporate multiple objectives into retrosynthesis planning. We present MMORF, a framework for constructing MAS for multi-objective retrosynthesis planning. MMORF features modular agentic components, which can be flexibly combined and configured into different systems, enabling principled evaluation and comparison of different system designs. Using MMORF, we construct two representative MAS: MASIL and RFAS. On a newl...
| Authors | Frazier N. Baker, Trieu Nguyen, Reza Averly et al. |
|---|---|
| Primary category | cs.AI |
| Published | 6 April 2026 |
| Last updated at source | 28 September 2026 |
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