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Roshni Iyer

Publications and source records attributed to Roshni Iyer.

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Improving Language Agents through BREW: Bootstrapping expeRientially-learned Environmental knoWledge

Large Language Model (LLM)-based agents are increasingly capable of complex, multi-step tasks such as GUI automation, tool use, and data manipulation, yet they cannot learn from experience: each new session rediscovers solutions from scratch. We introduce BREW (Bootstrapping expeRientially-learned Environmental knoWledge), a framework that distills an agent's past interaction trajectories into a structured, retrievable knowledge base (KB) of natural-language recipes, concept-level procedural documents that capture what to do, when it applies, and what to watch out for. Drawing on the principle of library learning from program synthesis, BREW decomposes agent memory into modular, concept-localized documents and formalizes KB construction as a state-space search problem. To navigate this space, we introduce Expand-and-Gather Monte Carlo Tree Search (EG-MCTS), a reward-guided algorithm that jointly optimizes recipe accuracy and retrievability across parallel, per-concept search trees. We further adapt hindsight relabeling to convert near-miss trajectories into positive demonstrations, surfacing latent agent competencies as reusable knowledge. On three domain-grounded benchmarks, OSWorld, tau^2-Bench, and SpreadSheetBench, BREW achieves 10-20% gains in task success and 10-15% fewer execution steps over base agents, while consistently outperforming existing memory-augmented baselines that can degrade below memoryless performance. The resulting KB is inspectable, modular, and extensible, providing a transparent and controllable substrate for agent optimization.

cs.AI

MolX: Enhancing Large Language Models for Molecular Understanding With A Multi-Modal Extension

Large Language Models (LLMs) with their strong task-handling capabilities have shown remarkable advancements across a spectrum of fields, moving beyond natural language understanding. However, their proficiency within the chemistry domain remains restricted, especially in solving molecule-related tasks. This challenge is attributed to their inherent limitations in comprehending molecules using only common textual representations, i.e. SMILES strings. In this study, we seek to enhance the ability of LLMs to comprehend molecules by equipping them with a multi-modal external module, termed MolX. Instead of directly using SMILES strings to represent a molecule, we utilize specific encoders to extract fine-grained features from both SMILES string and 2D molecular graph representations for feeding into an LLM. A hand-crafted molecular fingerprint is incorporated to leverage its embedded domain knowledge. To establish an alignment between MolX and the LLM's textual input space, the model in which the LLM is frozen, is pre-trained with a strategy including a diverse set of tasks. Experimental evaluations show that our proposed method outperforms baselines across downstream molecule-related tasks ranging from molecule-to-text translation to molecular property prediction, with and without fine-tuning the LLM, while only introducing a small number of trainable parameters-0.53% and 0.82%, respectively.

cs.CV