Keyao Ding

Wei Liu, Yang Gu, Xi Yan et al.

Table processing-including cleaning, transformation, augmentation, and matching-is a foundational yet error-prone stage in real-world data pipelines. While recent LLM-based approaches show promise for automating such tasks, they often struggle in practice due to ambiguous instructions, complex task structures, and the lack of structured feedback, resulting in syntactically correct but semantically flawed code. To address these challenges, we propose ProfiliTable, an autonomous multi-agent framework centered on dynamic profiling, which constructs and iteratively refines a unified execution context through interactive exploration, knowledge-augmented synthesis, and feedback-driven refinement. ProfiliTable integrates (i) a Profiler that performs ReAct-style data exploration to build semantic understanding, (ii) a Generator that retrieves curated operators to synthesize task-aware code, and (iii) an Evaluator-Summarizer loop that injects execution scores and diagnostic insights to enable closed-loop refinement. Extensive experiments on a diverse benchmark covering 18 tabular task types demonstrate that ProfiliTable consistently outperforms strong baselines, particularly in complex multi-step scenarios. These results highlight the critical role of dynamic profiling in reliably translating ambiguous user intents into robust and governance-compliant table transformations.

Beicheng Xu, Keyao Ding, Wei Liu et al.

Feature Engineering (FE) is pivotal in automated machine learning (AutoML) but remains a bottleneck for traditional methods, which treat it as a black-box search, operating within rigid, predefined search spaces and lacking domain awareness. While Large Language Models (LLMs) offer a promising alternative by leveraging semantic reasoning to generate unbounded operators, existing methods fail to construct free-form FE pipelines, remaining confined to isolated subtasks such as feature generation. Most importantly, they are rarely optimized jointly with hyperparameter optimization (HPO) of the ML model, leading to greedy "FE-then-HPO" workflows that cannot capture strong FE-HPO interactions. In this paper, we present CoFEH, a collaborative framework that interleaves LLM-based FE and Bayesian HPO for robust end-to-end AutoML. CoFEH uses an LLM-driven FE optimizer powered by Tree of Thought (ToT) to explore flexible FE pipelines, a Bayesian optimization (BO) module to solve HPO, and a dynamic optimizer selector that realizes interleaved optimization by adaptively scheduling FE and HPO steps. Crucially, we introduce a mutual conditioning mechanism that shares context between LLM and BO, enabling mutually informed decisions. Experiments show that CoFEH not only outperforms traditional and LLM-based FE baselines, but also achieves superior end-to-end performance under joint optimization.

Beicheng Xu, Wei Liu, Keyao Ding et al.

The Combined Algorithm Selection and Hyperparameter Optimization (CASH) problem is fundamental in Automated Machine Learning (AutoML). Inspired by the success of ensemble learning, recent AutoML systems construct post-hoc ensembles for final predictions rather than relying on the best single model. However, while most CASH methods conduct extensive searches for the optimal single model, they typically employ fixed strategies during the ensemble phase that fail to adapt to specific task characteristics. To tackle this issue, we propose PSEO, a framework for post-hoc stacking ensemble optimization. First, we conduct base model selection through binary quadratic programming, with a trade-off between diversity and performance. Furthermore, we introduce two mechanisms to fully realize the potential of multi-layer stacking. Finally, PSEO builds a hyperparameter space and searches for the optimal post-hoc ensemble strategy within it. Empirical results on 80 public datasets show that \sys achieves the best average test rank (2.96) among 16 methods, including post-hoc designs in recent AutoML systems and state-of-the-art ensemble learning methods.