Tat-Seng Chua
Publications
Mechanist: AI as a Scientific Instrument for Discovering the Mechanisms of Intelligence
AI models have achieved remarkable success across diverse domains, yet the mechanisms underlying their capabilities and the risks they may pose remain poorly understood. As AI development becomes faster and increasingly automated, mechanistic exploration remains largely manual, widening the gap between what models can do and our ability to understand and control them. To bridge this gap, we introduce Mechanist, an agentic system that uses AI as a scientific instrument for the autonomous discovery of mechanisms underlying AI intelligence. To support autonomous mechanistic discovery, we construct an interpretability-focused knowledge graph of approximately 13,000 papers and integrate it with a multidisciplinary database of 43 million papers spanning 26 fields. We further curate a library of 32 foundational methods for mechanism analysis, causal intervention, and validation. Compared with Claude Code and existing AI-scientist systems, Mechanist generates more valuable mechanism hypotheses and executes experiments more reliably. Mechanist also demonstrates a progression from discovering model behaviors to explaining and controlling AI models. Specifically, Mechanist first uncovers a counterintuitive safety risk in scientific laboratories, showing that unsafe traits can transfer across modalities through apparently safe training data. Mechanist then develops a mechanism theory of belief, revealing how models represent world knowledge, form beliefs, infer the beliefs of others, and how these mechanisms emerge during pretraining. Finally, Mechanist translates these mechanistic insights into practical interventions that improve model performance across diverse scenarios and steer scientific foundation models toward generating DNA sequences with specified properties.
Continual Learning in Transition
Classical continual learning (CL) has primarily focused on enabling models to update and retain knowledge through parameter-centric mechanisms, e.g., training strategies, architectural designs, and weight adaptation. However, emerging paradigms are reshaping the scope of CL beyond this traditional model adaptation view. For instance, on-policy learning broadens the space of update mechanisms; test-time training extends CL from the training phase to inference; and external harness components such as memory, skill libraries, and interaction protocols extend the evolutionary boundaries of model capabilities far beyond the static parameter space. Collectively, these developments indicate a transition from parameter-centric learning toward system-level adaptation. To characterize this transition, we examine the evolution of continual learning through three dimensions: When, How, and Where learning occurs. The How dimension encompasses off-policy, on-policy, and beyond-gradient optimization mechanics. The When dimension captures evolution across pre-training, post-training, and inference-time stages. The Where dimension delineates updates occurring within internal parameters versus external structural constraints. Anchored by this tri-axial framework, we systematically survey representative methods, trace the ongoing transition of continual learning, and discuss the key challenges, broader implications, and future directions arising from this paradigm shift.
OPD-V: Visual On-Policy Self-Distillation with Modality Balance
On-Policy Self-Distillation (OPSD) has become a standard post-training approach for improving visual reasoning in multimodal large language models (MLLMs). Existing methods draw privileged information from diverse input sources to guide self-distillation. Yet these designs overlook Modality Imbalance, a challenge inherent to MLLM reasoning. When textual information dominates generation, the model cannot fully integrate its multimodal input. Consequently, carefully designed privileged information remains underused, limiting the effectiveness of OPSD. To examine this limitation, we construct a Positive Teacher with the Zoom-In Image and a Negative Teacher with the Mask Image, which exhibit different degrees of Modality Imbalance. Changes in their reasoning correctness and token logits reveal that Modality Balance can itself serve as privileged information. Motivated by this finding, we introduce OPD-V, a visual OPSD paradigm that instantiates such information through the Positive Teacher and Negative Teacher. Positive Modality-Balance Logits Margins define a Modality-Balance Trust Region that selects the on-policy tokens used for self-distillation. Experiments across 6 benchmarks, 4 MLLM backbones, and 5 post-training methods show that OPD-V consistently improves reasoning performance while reducing training cost.
ReflectRL: Learning from Golden Negative Trajectories via Reflective-to-Direct Reasoning
On-policy training has emerged as a powerful post-training paradigm for improving the reasoning capabilities of large language models, and is often enhanced by golden trajectories from stronger expert models. However, when the expert fails on harder problems, existing trajectory-guided methods lose their main source of supervision, and these failed trajectories are typically discarded as negative samples. We argue that such failures, which we call Golden Negative Trajectories, can still provide valuable reasoning signals when treated not as demonstrations to imitate, but as flawed trajectories to reflect upon. We identify a Reflection Advantage: for hard problems, reflecting on a flawed trajectory can be easier and more effective than solving the problem directly from scratch. Motivated by this, we propose ReflectRL, a lightweight plug-and-play framework that learns from Golden Negative Trajectories during on-policy training. ReflectRL first uses these trajectories to elicit Reflective Reasoning, then applies Reflective-to-Direct Policy Transition to transfer the acquired reasoning behavior back to Direct Reasoning. Experiments across 9 benchmarks, 4 LLM backbones, and 4 on-policy training methods show that ReflectRL consistently improves reasoning performance with minimal overhead.
SafeNexus: Discovering and Steering Modality-Universal Safety Neurons in MLLMs
Although Large Language Models (LLMs) have demonstrated promising safety performance, extending them to Multimodal Large Language Models (MLLMs) exposes a significant gap between expanded multimodal capabilities and existing safety mechanisms. Current defenses remain predominantly confined to specific modal settings, thereby limiting their robustness against broader cross-modal threats. To bridge this gap, we introduce SafeNexus, a cross-modal safety alignment framework that adopts a dedicated neuron-level intervention strategy. First, we formulate a neuron localization paradigm that identifies functionally specialized neurons by characterizing intermediate-layer activation patterns and quantifying their functional salience through importance scoring. Building upon this paradigm, we exploit contrastive data to identify modality-bound safety neurons (BS-Neurons), and validate their role in regulating safety behavior within each modality via targeted suppression. Further cross-modal analysis defines modality-universal safety neurons (US-Neurons) as the shared subset of BS-Neurons identified across individual modalities, serving as the core for defending against harmful cross-modal attacks. We observe that suppressing these neurons substantially degrades safety performance across modalities, while leaving overall utility largely unaffected. Building on these insights, we propose two safety alignment strategies: activation-level safety amplifier and safety neuron calibrator. The proposed strategies enhance model safety through two distinct routes: the former amplifies the activation magnitudes of US-Neurons, while the latter selectively calibrates them via targeted fine-tuning. Extensive experiments demonstrate that our method outperforms prevailing state-of-the-art approaches on safety benchmarks spanning diverse modality combinations, while effectively preserving utility.
Rubric-based On-policy Distillation
On-policy distillation (OPD) is a powerful paradigm for model alignment, yet its reliance on teacher logits restricts its application to white-box scenarios. We contend that structured semantic rubrics can serve as a scalable alternative to teacher logits, enabling OPD using only teacher-generated responses. To prove it, we introduce ROPD, a simple yet foundational framework for rubric-based OPD. Specifically, ROPD induces prompt-specific rubrics from teacher-student contrasts, and then utilizes these rubrics to score the student rollouts for on-policy optimization. Empirically, ROPD outperforms the advanced logit-based OPD methods across most scenarios, and achieving up to a 10x gain in sample efficiency. These results position rubric-based OPD as a flexible, black-box-compatible alternative to the prevailing logit-based OPD, offering a simple yet strong baseline for scalable distillation across proprietary and open-source LLMs. Code is available at https://github.com/Peregrine123/ROPD_official.
On the Implicit Reward Overfitting and the Low-rank Dynamics in RLVR
Recent extensive research has demonstrated that the enhanced reasoning capabilities acquired by models through Reinforcement Learning with Verifiable Rewards (RLVR) are primarily concentrated within the rank-1 components. Predicated on this observation, we employed Periodic Rank-1 Substitution and identified a counterintuitive phenomenon: RLVR may exhibit implicit reward overfitting to the training dataset. Specifically, the model can achieve satisfactory performance on the test set even when its rewards remain relatively low during the training process. Furthermore, we characterize three distinct properties of RL training: (1) The effective rank-1 component in RLVR don't maintain other model knowledge except mathematical reasoning capability. (2) RLVR fundamentally functions by optimizing a specific singular spectrum. The distribution of singular values of almost all linear layers in RLVR-trained model behaves like heavy-tailed distribution. (3) the left singular vectors associated with rank-1 components demonstrate a stronger alignment tendency during training, which echoes the discovery that RLVR is optimizing sampling efficiency in essence. Taken together, our findings and analysis further reveal how RLVR shapes model parameters and offer potential insights for improving existing RL paradigms or other training paradigms to implement continual learning.
Unifying Group-Relative and Self-Distillation Policy Optimization via Sample Routing
Reinforcement learning with verifiable rewards (RLVR) has become a standard paradigm for post-training large language models. While Group Relative Policy Optimization (GRPO) is widely adopted, its coarse credit assignment uniformly penalizes failed rollouts, lacking the token-level focus needed to efficiently address specific deviations. Self-Distillation Policy Optimization (SDPO) addresses this by providing denser, more targeted logit-level supervision that facilitates rapid early improvement, yet it frequently collapses during prolonged training. We trace this late-stage instability to two intrinsic flaws: self-distillation on already-correct samples introduces optimization ambiguity, and the self-teacher's signal reliability progressively degrades. To resolve these issues, we propose Sample-Routed Policy Optimization (SRPO), a unified on-policy framework that routes correct samples to GRPO's reward-aligned reinforcement and failed samples to SDPO's targeted logit-level correction. SRPO further incorporates an entropy-aware dynamic weighting mechanism to suppress high-entropy, unreliable distillation targets while emphasizing confident ones. Evaluated across five benchmarks and two model scales, SRPO achieves both the rapid early improvement of SDPO and the long-horizon stability of GRPO. It consistently surpasses the peak performance of both baselines, raising the five-benchmark average on Qwen3-8B by 3.4% over GRPO and 6.3% over SDPO, while simultaneously yielding moderate response lengths and lowering per-step compute cost by up to 17.2%.
AgentNoiseBench: Benchmarking Robustness of Tool-Using LLM Agents Under Noisy Condition
Recent advances in large language models have enabled LLM-based agents to achieve strong performance on a variety of benchmarks. However, their performance in real-world deployments often that observed on benchmark settings, especially in complex and imperfect environments. This discrepancy largely arises because prevailing training and evaluation paradigms are typically built on idealized assumptions, overlooking the inherent stochasticity and noise present in real-world interactions. To bridge this gap, we introduce AgentNoiseBench, a framework for systematically evaluating the robustness of agentic models under noisy environments. We first conduct an in-depth analysis of biases and uncertainties in real-world scenarios and categorize environmental noise into two primary types: user-noise and tool-noise. Building on this analysis, we develop an automated pipeline that injects controllable noise into existing agent-centric benchmarks while preserving task solvability. Leveraging this pipeline, we perform extensive evaluations across a wide range of models with diverse architectures and parameter scales. Our results reveal consistent performance variations under different noise conditions, highlighting the sensitivity of current agentic models to realistic environmental perturbations.