Abstract:We study a class of emergent misalignment in multi-agent systems (MAS), with a focus on automated workflows, which we refer to agentic misalignment. Although these systems can solve complex tasks, they often fail because agents act according to implicit proxy utilities that do not align with the intended human goals. We formally define these behaviors and analyze them within a Bayesian framework, showing that generic utilities naturally lead to posterior collapse of agents in automated workflows. To address this issue, we propose Agentic Evidence Attribution (AEA), a novel alignment paradigm that improves agent posteriors using context-specific evidence. AEA reasons over agent actions and provides structured evidence to correct misaligned behavior during collaboration. To better understand the role of evidence, we study two instantiations of AEA: self-reflection (internal evidence from the model) and weak-to-strong generalization (external evidence on the agentic trajectory). We show that a small evidence model effectively aligns the MAS by providing orthogonal failure attribution. Our results clarify the sources of agentic misalignment in automated workflows and show that evidence-based alignment can effectively improve agent collaboration and leads to reliable multi-agent systems built on automated workflows.
Abstract:Large Vision Language Models (LVLMs) show promise in medical applications, but their inability to faithfully ground responses in visual evidence raises serious concerns about clinical trustworthiness. While visual attribution methods are widely used to explain LVLM predictions, whether these explanations actually reflect the visual evidence underlying the model's decision is largely unverified, since ground-truth annotations for internal model reasoning are typically unavailable. We address this question for chest X-ray (CXR) reasoning by developing a causal evaluation framework that retains only CXR-VQA samples for which the expert-annotated region is verified, via counterfactual editing, to be causally responsible for the model's prediction. Using this framework across 11 attribution methods, six open-source LVLMs, and two output modes (direct answer and step-by-step reasoning), we find that existing attribution methods often fail to identify the evidence used by LVLMs. To address this failure, we propose MedFocus, a concept-based attribution method that localizes clinically meaningful anatomical regions via unbalanced optimal transport and measures their causal effect on model outputs through targeted interventions. MedFocus produces spatial, concept-level, and token-level attributions and substantially outperforms prior methods, taking a step toward more trustworthy attribution for medical LVLMs. Our data and code are available at https://github.com/gzxiong/medfocus/.
Abstract:Vision-language models (VLMs) have achieved impressive performance across a wide range of multimodal reasoning tasks, but they often struggle to disentangle fine-grained visual attributes and reason about underlying causal relationships. In-context learning (ICL) offers a promising avenue for VLMs to adapt to new tasks, but its effectiveness critically depends on the selection of demonstration examples. Existing retrieval-augmented approaches typically rely on passive similarity-based retrieval, which tends to select correlated but non-causal examples, amplifying spurious associations and limiting model robustness. We introduce CIRCLES (Composed Image Retrieval for Causal Learning Example Selection), a novel framework that actively constructs demonstration sets by retrieving counterfactual-style examples through targeted, attribute-guided composed image retrieval. By incorporating counterfactual-style examples, CIRCLES enables VLMs to implicitly reason about the causal relations between attributes and outcomes, moving beyond superficial correlations and fostering more robust and grounded reasoning. Comprehensive experiments on four diverse datasets demonstrate that CIRCLES consistently outperforms existing methods across multiple architectures, especially on small-scale models, with pronounced gains under information scarcity. Furthermore, CIRCLES retrieves more diverse and causally informative examples, providing qualitative insights into how models leverage in-context demonstrations for improved reasoning. Our code is available at https://github.com/gzxiong/CIRCLES.
Abstract:Assessing whether an article supports an assertion is essential for hallucination detection and claim verification. While large language models (LLMs) have the potential to automate this task, achieving strong performance requires frontier models such as GPT-5 that are prohibitively expensive to deploy at scale. To efficiently perform biomedical evidence attribution, we present Med-V1, a family of small language models with only three billion parameters. Trained on high-quality synthetic data newly developed in this study, Med-V1 substantially outperforms (+27.0% to +71.3%) its base models on five biomedical benchmarks unified into a verification format. Despite its smaller size, Med-V1 performs comparably to frontier LLMs such as GPT-5, along with high-quality explanations for its predictions. We use Med-V1 to conduct a first-of-its-kind use case study that quantifies hallucinations in LLM-generated answers under different citation instructions. Results show that the format instruction strongly affects citation validity and hallucination, with GPT-5 generating more claims but exhibiting hallucination rates similar to GPT-4o. Additionally, we present a second use case showing that Med-V1 can automatically identify high-stakes evidence misattributions in clinical practice guidelines, revealing potentially negative public health impacts that are otherwise challenging to identify at scale. Overall, Med-V1 provides an efficient and accurate lightweight alternative to frontier LLMs for practical and real-world applications in biomedical evidence attribution and verification tasks. Med-V1 is available at https://github.com/ncbi-nlp/Med-V1.
Abstract:The trade-off between interpretability and accuracy remains a core challenge in machine learning. Standard Generalized Additive Models (GAMs) offer clear feature attributions but are often constrained by their strictly additive nature, which can limit predictive performance. Introducing feature interactions can boost accuracy yet may obscure individual feature contributions. To address these issues, we propose Neural Additive Experts (NAEs), a novel framework that seamlessly balances interpretability and accuracy. NAEs employ a mixture of experts framework, learning multiple specialized networks per feature, while a dynamic gating mechanism integrates information across features, thereby relaxing rigid additive constraints. Furthermore, we propose targeted regularization techniques to mitigate variance among expert predictions, facilitating a smooth transition from an exclusively additive model to one that captures intricate feature interactions while maintaining clarity in feature attributions. Our theoretical analysis and experiments on synthetic data illustrate the model's flexibility, and extensive evaluations on real-world datasets confirm that NAEs achieve an optimal balance between predictive accuracy and transparent, feature-level explanations. The code is available at https://github.com/Teddy-XiongGZ/NAE.
Abstract:While the ecosystem of Lean and Mathlib has enjoyed celebrated success in formal mathematical reasoning with the help of large language models (LLMs), the absence of many folklore lemmas in Mathlib remains a persistent barrier that limits Lean's usability as an everyday tool for mathematicians like LaTeX or Maple. To address this, we introduce MathlibLemma, the first LLM-based multi-agent system to automate the discovery and formalization of mathematical folklore lemmas. This framework constitutes our primary contribution, proactively mining the missing connective tissue of mathematics. Its efficacy is demonstrated by the production of a verified library of folklore lemmas, a subset of which has already been formally merged into the latest build of Mathlib, thereby validating the system's real-world utility and alignment with expert standards. Leveraging this pipeline, we further construct the MathlibLemma benchmark, a suite of 4,028 type-checked Lean statements spanning a broad range of mathematical domains. By transforming the role of LLMs from passive consumers to active contributors, this work establishes a constructive methodology for the self-evolution of formal mathematical libraries.
Abstract:Internal activations of diffusion models encode rich semantic information, but interpreting such representations remains challenging. While Sparse Autoencoders (SAEs) have shown promise in disentangling latent representations, existing SAE-based methods for diffusion model understanding rely on unsupervised approaches that fail to align sparse features with human-understandable concepts. This limits their ability to provide reliable semantic control over generated images. We introduce CASL (Concept-Aligned Sparse Latents), a supervised framework that aligns sparse latent dimensions of diffusion models with semantic concepts. CASL first trains an SAE on frozen U-Net activations to obtain disentangled latent representations, and then learns a lightweight linear mapping that associates each concept with a small set of relevant latent dimensions. To validate the semantic meaning of these aligned directions, we propose CASL-Steer, a controlled latent intervention that shifts activations along the learned concept axis. Unlike editing methods, CASL-Steer is used solely as a causal probe to reveal how concept-aligned latents influence generated content. We further introduce the Editing Precision Ratio (EPR), a metric that jointly measures concept specificity and the preservation of unrelated attributes. Experiments show that our method achieves superior editing precision and interpretability compared to existing approaches. To the best of our knowledge, this is the first work to achieve supervised alignment between latent representations and semantic concepts in diffusion models.
Abstract:Chain-of-Thought (CoT) prompting has improved the reasoning performance of large language models (LLMs), but it remains unclear why it works and whether it is the unique mechanism for triggering reasoning in large language models. In this work, we study this question by directly analyzing and intervening on the internal representations of LLMs with Sparse Autoencoders (SAEs), identifying a small set of latent features that are causally associated with LLM reasoning behavior. Across multiple model families and reasoning benchmarks, we find that steering a single reasoning-related latent feature can substantially improve accuracy without explicit CoT prompting. For large models, latent steering achieves performance comparable to standard CoT prompting while producing more efficient outputs. We further observe that this reasoning-oriented internal state is triggered early in generation and can override prompt-level instructions that discourage explicit reasoning. Overall, our results suggest that multi-step reasoning in LLMs is supported by latent internal activations that can be externally activated, while CoT prompting is one effective, but not unique, way of activating this mechanism rather than its necessary cause.




Abstract:Retrieval-Augmented Generation (RAG) improves the factuality of large language models (LLMs) by grounding outputs in retrieved evidence, but faithfulness failures, where generations contradict or extend beyond the provided sources, remain a critical challenge. Existing hallucination detection methods for RAG often rely either on large-scale detector training, which requires substantial annotated data, or on querying external LLM judges, which leads to high inference costs. Although some approaches attempt to leverage internal representations of LLMs for hallucination detection, their accuracy remains limited. Motivated by recent advances in mechanistic interpretability, we employ sparse autoencoders (SAEs) to disentangle internal activations, successfully identifying features that are specifically triggered during RAG hallucinations. Building on a systematic pipeline of information-based feature selection and additive feature modeling, we introduce RAGLens, a lightweight hallucination detector that accurately flags unfaithful RAG outputs using LLM internal representations. RAGLens not only achieves superior detection performance compared to existing methods, but also provides interpretable rationales for its decisions, enabling effective post-hoc mitigation of unfaithful RAG. Finally, we justify our design choices and reveal new insights into the distribution of hallucination-related signals within LLMs. The code is available at https://github.com/Teddy-XiongGZ/RAGLens.
Abstract:Large vision-language models, such as CLIP, have shown strong zero-shot classification performance by aligning images and text in a shared embedding space. However, CLIP models often develop multimodal spurious biases, which is the undesirable tendency to rely on spurious features. For example, CLIP may infer object types in images based on frequently co-occurring backgrounds rather than the object's core features. This bias significantly impairs the robustness of pre-trained CLIP models on out-of-distribution data, where such cross-modal associations no longer hold. Existing methods for mitigating multimodal spurious bias typically require fine-tuning on downstream data or prior knowledge of the bias, which undermines the out-of-the-box usability of CLIP. In this paper, we first theoretically analyze the impact of multimodal spurious bias in zero-shot classification. Based on this insight, we propose Spuriousness-Aware Guided Exploration (SAGE), a simple and effective method that mitigates spurious bias through guided prompt selection. SAGE requires no training, fine-tuning, or external annotations. It explores a space of prompt templates and selects the prompts that induce the largest semantic separation between classes, thereby improving worst-group robustness. Extensive experiments on four real-world benchmark datasets and five popular backbone models demonstrate that SAGE consistently improves zero-shot performance and generalization, outperforming previous zero-shot approaches without any external knowledge or model updates.