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Hegang Chen

Publications and source records attributed to Hegang Chen.

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DoctorAgents: an agentic framework to iteratively refine AutoML pipeline for small clinical temporal data

Clinical machine learning (ML) has the potential to support high-stakes medical decision-making, but reliable deployment is often constrained by scarce, heterogeneous, and temporal complexity. Developing effective ML pipelines for such data remains time-consuming and error-prone, while existing automated machine learning (AutoML) systems only partially address this challenge because they largely rely on brute-force search over predefined spaces and lack explicit reasoning and memory. We therefore reformulate AutoML for small clinical data from exhaustive search to reasoning-driven refinement. We propose DoctorAgents, an agentic AI framework that autonomously constructs and optimizes end-to-end ML pipelines through specialized large language model (LLM) agents for generation, validation, and refinement. DoctorAgents backpropagates natural-language feedback through textual gradient descent to perform targeted updates without exhaustive search. Experiments across diverse clinical tasks show that DoctorAgents consistently outperforms established AutoML baselines while producing more interpretable task-specific representations.

cs.AI

Exploring the Paradigm Shift from Grounding to Skolemization for Complex Query Answering on Knowledge Graphs

Complex Query Answering (CQA) over incomplete Knowledge Graphs (KGs), typically formalized as reasoning with Existential First-Order predicate logic with one free variable (EFO\textsubscript{1}), faces a fundamental tradeoff between logic fidelity and computational efficiency. This work establishes a Grounding-Skolemization dichotomy to systematically analyze this challenge and motivate a paradigm shift in CQA. While Grounding-based methods inherently suffer from combinatorial explosion, most Skolemization-based methods neglect to explicitly model Skolem functions and compromise logical consistency. To address these limitations, we propose the Logic-constrained Vector Symbolic Architecture (LVSA), a neuro-symbolic framework that unifies a differentiable Skolemization module and a neural negator, as well as a logical constraint-driven optimization protocol to harmonize geometric and logical requirements. Theoretically, LVSA guarantees universality for all EFO\textsubscript{1} queries with low computational complexity. Empirically, it outperforms state-of-the-art Skolemization-based methods and reduces inference costs by orders of magnitude compared to Grounding-based baselines.

cs.AI

scE2TM improves single-cell embedding interpretability and reveals cellular perturbation signatures

Single-cell RNA sequencing technologies have revolutionized our understanding of cellular heterogeneity, yet computational methods often struggle to balance performance with biological interpretability. Embedded topic models have been widely used for interpretable single-cell embedding learning. However, these models suffer from the potential problem of interpretation collapse, where topics semantically collapse towards each other, resulting in redundant topics and incomplete capture of biological variation. Furthermore, the rise of single-cell foundation models creates opportunities to harness external biological knowledge for guiding model embeddings. Here, we present scE2TM, an external knowledge-guided embedded topic model that provides a high-quality cell embedding and interpretation for scRNA-seq analysis. Through embedding clustering regularization method, each topic is constrained to be the center of a separately aggregated gene cluster, enabling it to capture unique biological information. Across 20 scRNA-seq datasets, scE2TM achieves superior clustering performance compared with seven state-of-the-art methods. A comprehensive interpretability benchmark further shows that scE2TM-learned topics exhibit higher diversity and stronger consistency with underlying biological pathways. Modeling interferon-stimulated PBMCs, scE2TM simulates topic perturbations that drive control cells toward stimulated-like transcriptional states, faithfully mirroring experimental interferon responses. In melanoma, scE2TM identifies malignant-specific topics and extrapolates them to unseen patient data, revealing gene programs associated with patient survival.

cs.LG

Self-supervised Topic Taxonomy Discovery in the Box Embedding Space

Topic taxonomy discovery aims at uncovering topics of different abstraction levels and constructing hierarchical relations between them. Unfortunately, most of prior work can hardly model semantic scopes of words and topics by holding the Euclidean embedding space assumption. What's worse, they infer asymmetric hierarchical relations by symmetric distances between topic embeddings. As a result, existing methods suffer from problems of low-quality topics at high abstraction levels and inaccurate hierarchical relations. To alleviate these problems, this paper develops a Box embedding-based Topic Model (BoxTM) that maps words and topics into the box embedding space, where the asymmetric metric is defined to properly infer hierarchical relations among topics. Additionally, our BoxTM explicitly infers upper-level topics based on correlation between specific topics through recursive clustering on topic boxes. Finally, extensive experiments validate high-quality of the topic taxonomy learned by BoxTM.

cs.CL