Create README.md

README.md

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+---
+language:
+- en
+library_name: transformers
+tags:
+- chemistry
+- molecule-optimization
+- agentic-rl
+- grpo
+license: apache-2.0
+datasets:
+- little1d/mol_opt_data
+base_model:
+- little1d/MolEditAgent-3B
+---
+
+# MolOptAgent-{3B/7B}
+
+**MolOptAgent** is the Stage-2 model of the **MolAct** framework, continued training from MolEditAgent using **Agentic Reinforcement Learning (GRPO)**.
+
+### Key Features
+- **Objective:** Optimized for multi-step molecular property optimization (e.g., LogP, Solubility, QED, Bioactivity).
+- **Zero-Tolerance for Errors:** Guided by real-time tool feedback, it minimizes "Chemical Hallucinations" and ensures nearly 100% molecular validity.
+- **Performance:** Outperforms strong reasoning models like Claude-3.7 and DeepSeek-R1 in complex property-guided editing tasks.
+
+### Links
+- **GitHub Repository:** [https://github.com/little1d/MolAct](https://github.com/little1d/MolAct)
+- **Framework:** Agentic RL with tool-integrated feedback.