ICML 2026 论文列表

International Conference on Machine Learning

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6,341篇论文

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Breaking the Simplification Bottleneck in Amortized Neural Symbolic Regression

Paul Saegert, Ullrich Koethe

展开摘要

Symbolic regression (SR) aims to discover interpretable analytical expressions that accurately describe observed data. Amortized SR promises to be much more efficient than the predominant genetic programming SR methods, but currently struggles to scale to realistic scientific complexity. We find that a key obstacle is the lack of a fast reduction of equivalent expressions to a concise normalized form. Amortized SR has addressed this with general-purpose Computer Algebra Systems (CAS) like SymPy, but the high computational cost severely limits training and inference speed. We propose **SimpliPy**, a rule-based simplification engine achieving a 100-fold speed-up over SymPy at comparable quality. This enables substantial improvements in amortized SR, including scalability to much larger training sets, more efficient use of the per-expression token budget, and systematic training set decontamination with respect to equivalent test expressions. We demonstrate these advantages in our **Flash-ANSR** framework, which achieves much better accuracy than amortized baselines (NeSymReS, E2E) on the FastSRB benchmark. Moreover, it performs on par with state-of-the-art direct optimization (PySR) while recovering more concise rather than more complex expressions with increasing inference budget.

Poster
TileQ: Efficient Low-Rank Quantization of Mixture-of-Experts with 2D Tiling

Hongyaoxing Gu, Xinzhe Chen, Lijuan Hu, Liu fangfang

展开摘要

Mixture-of-Experts (MoE) models achieve remarkable performance by sparsely activating specialized experts, yet their massive parameters in experts pose significant challenges for deployment. While low-rank quantization offers a promising route to compress MoE models, existing methods still incur nonnegligible memory overhead and inference latency. To address these limitations, we propose TileQ, a fine-tuning-free post-training quantization (PTQ) method that employs 2D-tiling structured low-rank quantization to share low-rank factors across both input and output dimensions of MoE experts. Furthermore, we introduce an efficient inference technique for TileQ that fuses multiple low-rank expert computations into a single-pass operation, significantly improving hardware utilization. Experiments show that TileQ cuts down additional memory usage up to 10x and reduces inference latency to 5% while preserving state-of-the-art accuracy.

Poster
Stochastic Minimum-Cost Reach-Avoid Reinforcement Learning

Jingduo Pan, Taoran Wu, Yiling Xue, Bai Xue

展开摘要

We study stochastic minimum-cost reach-avoid reinforcement learning, where an agent must satisfy a reach-avoid specification with probability at least $p$ while minimizing expected cumulative costs in stochastic environments. Existing safe and constrained reinforcement learning methods typically fail to jointly enforce probabilistic reach-avoid constraints and optimize cost in the learning setting in stochastic environments. To address this challenge, we introduce reach-avoid probability certificates (RAPCs), which identify states from which stochastic reach-avoid constraints are satisfiable. Building on RAPCs, we develop a contraction-based Bellman formulation that serves as a principled surrogate for integrating reach-avoid considerations into reinforcement learning, enabling cost optimization under probabilistic constraints. We establish almost sure convergence of the proposed algorithms to locally optimal policies with respect to the resulting objective. Experiments in the MuJoCo simulator demonstrate improved cost performance and consistently higher reach-avoid satisfaction rates.

Poster
Direct Flow Q-Learning

Shicheng Cao, Jingrui Jia, Wenyu Li, Feng Duan, Tao Zhang, Shengbo Eben Li

展开摘要

Flow Matching shows great promise in offline reinforcement learning (RL), yet optimizing these iterative policies via Backpropagation Through Time (BPTT) is unstable. While prevailing paradigms circumvent this by distilling multi-step flows into single-step approximations, such methods may limit the benefits of iterative refinement. To avoid these sacrifices, we propose Direct Flow Q-Learning (DFQL), a streamlined framework that attains superior results by optimizing flow matching policies without BPTT or distillation. DFQL derives a surrogate objective that directly injects terminal Q-value gradients as a guidance term into each step velocity field, ensuring stable optimization while preserving iterative expressive capacity. Across 73 challenging tasks in OGBench and D4RL, DFQL achieves state-of-the-art results. Additionally, DFQL extends seamlessly to the offline-to-online setting, delivering substantial performance gains without further modification.

Poster
Prompt Optimization with Minimal Unlabeled Input via Meta-Reasoning

Yuran Sun, Chuan Wu

展开摘要

Prompt optimization is critical for maximizing the performance of large language models (LLMs). However, it often relies on costly labeled data. Self-supervised methods reduce data dependency, but they suffer from optimization ambiguity or high computational costs. To address these limitations, we propose the Meta-Reasoning Prompt Engineering Agent (MR.PEA), a self-supervised prompt optimization framework that operates with minimal input. MR.PEA leverages meta-reasoning to iteratively build task-specific knowledge, including problem-solving strategies and evaluation criteria, while adaptively retrieving external information to enhance its understanding. This knowledge guides the generation of diverse validation examples, targeted prompt refinement, and comprehensive quality assessments. Experiments on GSM8K and Big-Bench Hard show that MR.PEA outperforms existing baselines, achieving an average performance gain of 7.4% with an optimization cost as low as $0.01 per task.

Poster
Orthogonal Hierarchical Decomposition for Structure-Aware Table Understanding with Large Language Models

Bin Cao, huixian lu, chenwen ma, Ting Wang, Ruizhe Li, Jing Fan

展开摘要

Complex tables with multi-level headers, merged cells and heterogeneous layouts pose persistent challenges for large language models (LLMs) in both understanding and reasoning. Existing approaches typically rely on table linearization or normalized grid modeling. However, these representations struggle to explicitly capture hierarchical structures and cross-dimensional dependencies, which can lead to misalignment between structural semantics and textual representations for non-standard tables. To address this issue, we propose an Orthogonal Hierarchical Decomposition (OHD) framework that constructs structure-preserving input representations of complex tables for LLMs. OHD introduces an Orthogonal Tree Induction (OTI) method based on spatial--semantic co-constraints, which decomposes irregular tables into a column tree and a row tree to capture vertical and horizontal hierarchical dependencies, respectively. Building on this representation, we design a dual-pathway association protocol to symmetrically reconstruct the semantic lineage of each cell, and incorporate an LLM as a semantic arbitrator to align multi-level semantic information. We evaluate OHD framework on two complex table question answering benchmarks, AITQA and HiTab. Experimental results show that OHD consistently outperforms existing representation paradigms across multiple evaluation metrics.

Poster
Mind the Gap: Mixtures of Gaussians in Approximate Differential Privacy

Huikang Liu, Aras Selvi, Wolfram Wiesemann

展开摘要

We design a class of additive noise mechanisms that satisfy $(\varepsilon, \delta)$-differential privacy (DP) for scalar, real-valued query functions with known sensitivities, with a particular focus on moderate and low-privacy regimes. These mechanisms, which we call *mixture mechanisms*, are constructed by mixing multiple Gaussian distributions that share the same variance but differ in their means and mixture weights. The resulting distributions can be interpreted as convex combinations of a zero-mean Gaussian (as used in the analytic Gaussian mechanism) and additional Gaussians whose means depend on the sensitivity of the query function. We derive tight conditions on the variances required for $(\varepsilon, \delta)$-DP and provide efficient algorithms to compute them. Compared to the analytic Gaussian mechanism, our mechanisms yield substantially lower expected noise amplitudes ($l_1$-loss) and variances ($l_2$-loss for zero-mean distributions). In the low-privacy regime that motivates our design, our mechanisms approach optimality, mitigating nearly all of the optimality gap of the analytic Gaussian mechanism.

Poster
SmartThinker: Progressive Chain-of-Thought Length Calibration for Efficient Large Language Model Reasoning

Chenzhi Hu, Qinzhe Hu, Yuhang Xu, Junyi Chen, Ruijie Wang, Shengzhong Liu, Jianxin Li, Fan Wu, Guihai Chen

展开摘要

Large reasoning models (LRMs) like OpenAI o1 and DeepSeek-R1 achieve high accuracy on complex tasks by adopting long chain-of-thought (CoT) reasoning paths. However, the inherent verbosity of these processes frequently results in redundancy and overthinking. To address this issue, existing works leverage Group Relative Policy Optimization (GRPO) to reduce LRM output length, but their static length-reward designs fail to adapt to problem difficulty and response-length distributions, causing over-compression and compromised accuracy. Therefore, we propose *SmartThinker*, a novel GRPO-based efficient reasoning method with progressive CoT length calibration. *SmartThinker* makes a two-fold contribution: First, it dynamically estimates the optimal length with peak accuracy during training and guides overlong responses toward it to reduce reasoning length while sustaining accuracy. Second, it dynamically modulates the length-reward coefficient to avoid the unwarranted penalization of correct reasoning paths. Extensive experimental results show that *SmartThinker* achieves up to 52.6\% length compression with improved accuracy and achieves up to 16.6\% accuracy relative improvement on challenging benchmarks like AIME25. The source code can be found at https://github.com/SJTU-RTEAS/SmartThinker.

Poster
Omni-fMRI: A Universal Atlas-Free fMRI Foundation Model

Mo wang, Wenhao Ye, Junfeng Xia, Junxiang Zhang, Xuanye Pan, Minghao Xu, Haotian Deng, Hongkai Wen, Quanying Liu

展开摘要

Self-supervised fMRI foundation models have shown promising transfer performance, yet most rely on predefined region-level parcellations that discard fine-grained voxel information and introduce atlas-dependent biases. We propose Omni-fMRI, an atlas-free foundation model that operates directly on voxel-level signals. To enable scalable pretraining on 49,497 fMRI sessions across nine datasets, Omni-fMRI introduces a dynamic patching mechanism that substantially reduces computational cost while preserving informative spatial structure. To support reproducibility and fair comparison, we establish a comprehensive benchmark suite spanning 11 datasets and a diverse set of resting-state and task-based fMRI tasks. Experimental results demonstrate that Omni-fMRI consistently outperforms existing foundation models, providing a scalable and reproducible framework for atlas-free brain representation learning. Code is available.

Poster
Alignment Risks from Capability-Seeking RL Training

Yujun Zhou, Yue Huang, Han Bao, Kehan Guo, Zhenwen Liang, Pin-Yu Chen, Tian Gao, Werner Geyer, Nuno Moniz, Nitesh V Chawla, Xiangliang Zhang

展开摘要

While most AI alignment research focuses on preventing models from generating explicitly harmful content, a more subtle risk arises from capability-seeking RL training in vulnerable environments. We investigate whether language models, when trained with reinforcement learning (RL) in environments with implicit loopholes, can learn to exploit these flaws to maximize reward, even without being explicitly instructed to do so. To test this, we design a suite of four diverse "vulnerability games'', each presenting a structural vulnerability related to context-conditional compliance, proxy metrics, reward tampering, and self-evaluation. Our experiments show that models often learn to exploit these vulnerabilities, discovering opportunistic strategies that increase reward while sometimes preserving or even improving standard task-performance metrics. More critically, we find that these exploitative strategies are not always narrow "tricks'': they can transfer in structured but limited ways, propagate from a capable teacher model to other student models through SFT, and in several cases remain more persistent when learned through RL than when distilled through SFT. Our findings show that alignment risks from capability-seeking RL training can be difficult to detect with standard performance monitoring, suggesting that future AI safety work should extend beyond content moderation to auditing and securing training environments, reward mechanisms, and evaluation channels. Code is available at https://github.com/YujunZhou/Capability-seeking-RL-risk.

Poster
Interleaved Selective State Space Models for Efficient WiFi-Based 3D Multi-Person Pose Estimation

Quang-Anh N.D., Kok-Seng Wong

展开摘要

WiFi-based human pose estimation offers privacy-preserving and occlusion-robust sensing, but current Transformer-based approaches suffer from quadratic complexity and lack explicit inductive biases for the structure of Channel State Information (CSI). We propose WiFi-Mamba, the first State Space Model (SSM) architecture for WiFi-based 3D multi-person pose estimation. Our approach introduces three key contributions: (1) a Dual-Stream Selective SSM that processes amplitude and phase through parallel pathways with cross-stream state coupling to respect their distinct physical properties, (2) Selective State Attention for pose query decoding with SSM-derived sequential context, and (3) Persistent SSM Memory for temporal consistency across frames without recurrent memory explosion. Extensive experiments on the Person-in-WiFi 3D dataset, covering both single-person and multi-person, demonstrate a 16-27% MPJPE reduction across varying numbers of persons while using only 4.4\% of the baseline parameters (2.14M vs. 48.2M), achieving superior efficiency-accuracy trade-offs particularly beneficial for edge deployment in privacy-sensitive continuous monitoring scenarios.

Poster
AutoRPA: Efficient GUI Automation through LLM-Driven Code Synthesis from Interactions

Minghao Chen, Xinyi Hu, Zhou Yu, Yufei Yin

展开摘要

Large Language Model (LLM) based agents have demonstrated proficiency in multi-step interactions with graphical user interfaces (GUIs). While most research focuses on improving single-task performance, practical scenarios often involve repetitive GUI tasks for which invoking LLM reasoning repeatedly, i.e., the ReAct paradigm, is inefficient. Prior to LLMs, traditional Robotic Process Automation (RPA) offers runtime efficiency but demands significant manual effort to develop and maintain. To bridge this gap, we propose \textbf{AutoRPA}, a framework that automatically distills the decision logic of ReAct-style agents into robust RPA functions. AutoRPA introduces two core innovations: (1) A \textit{translator-builder pipeline} where a translator agent converts hard-coded ReAct actions into soft-coded procedures, and a builder agent synthesizes robust RPA functions via retrieval-augmented generation over multiple trajectories; (2) A \textit{hybrid repair strategy} during code verification, combining RPA execution with ReAct-based fallback for iterative refinement. Experiments across multiple GUI environments demonstrate that RPA functions generated by AutoRPA successfully solve similar tasks while reducing token usage by 82\%\textasciitilde96\%, significantly improving runtime efficiency and reusability.

Poster
Robust Linear Dueling Bandits with Post-serving Context under Unknown Delays and Adversarial Corruptions

Youngmin Oh

展开摘要

We study linear dueling bandits in volatile environments characterized by the simultaneous presence of post-serving contexts, delayed feedback, and adversarial corruption. Feedback is subject to unknown stochastic or adversarial delays and a cumulative corruption budget $\mathcal{C}$. To address these challenges, we propose RCDP-UCB, which integrates a learned approximator that predicts post-serving contexts from pre-serving information. It further employs an adaptive weighting strategy that clips feature vectors to mitigate the impact of corrupted and delayed observations simultaneously. Under standard regularity conditions and a parametric post-serving mapping, we rigorously establish that our algorithm is delay-regime-agnostic, achieving a regret upper bound of $\widetilde{\mathcal{O}}(d(\sqrt{T} + \mathcal{C} + \mathcal{D}))$, where $d$ is the total feature dimension and $\mathcal{D}$ encapsulates the delay complexity, scaling with $\sqrt{\Lambda}$ under adversarial delays or $\mu_{\tau}$ under stochastic delays ($\Lambda$: cumulative delay budget; $\mu_{\tau}$: mean of sub-Gaussian delays). We further establish lower bounds that nearly match our upper bounds up to a $\sqrt{d}$ factor for adversarial delays in the absence of post-serving contexts. Code is available at \url{https://github.com/youngmin0oh/rcdp-public}.

Poster
SOPE: Situation-Aware and Statistically Indistinguishable Privacy Exfiltration for MCP-enabled Agents

Ruixiao Lin, Qingming Li, Jiahao Chen, Chunyi Zhou, Shouling Ji

展开摘要

The Model Context Protocol (MCP) enables Large Language Model (LLM) agents to interact with external tools, but this extensibility introduces significant supply chain vulnerabilities that enable covert privacy exfiltration. Prior studies have revealed privacy leakage in MCP-enabled agents via indirect prompt injection; however, existing attacks are typically misaligned with the agent's tool-usage context and rely on rigid templates, resulting in recognizable patterns that are readily flagged by existing defenses. In this work, we exploit the observation that privacy exposure is inherently scenario-dependent, to associate certain privacy items with specific tools. We introduce `SOPE`, a Scenario-aware and zerO-click Privacy Exfiltration framework that transforms any benign MCP server into its privacy-exfiltrating variants. `SOPE` (1) identifies privacy items that are appropriate to the tool usage, (2) embeds privacy-probing instructions into tool-invocation prompts, and (3) achieves zero-click data transmission via code-level modifications. We evaluate `SOPE` across 27,216 test cases, where 324 `SOPE`-transformed *real-world* servers attacking four benchmark and three commercial agents with *nine* state-of-the-art defenses. Results demonstrate that `SOPE` remains highly effective and robust, highlighting critical protocol-level safety gaps in the agent ecosystem.

Poster
A Decision-Theoretic View of Test-Time Training: When, How Far, and Which Directions to Adapt

Tomoya Wakayama

展开摘要

Test-time training (TTT) adapts a pretrained model to each prompt via parameter updates, improving accuracy under pretraining-to-test distribution shifts. Yet, its performance often suffers from instability and sensitivity to hyperparameters such as update steps and subspace. We explain this behavior through a decision-theoretic lens, treating TTT as implicit Bayesian inference in the kernel regime. Under a Gaussian process benchmark, we show that TTT reduces prediction error when updates are spectrally matched to the prompt's signal-to-noise ratio and aligned with query-relevant eigen-directions. This perspective underpins the following results: (1) we show when fixed update steps and subspaces fail under distribution shifts, motivating adaptive strategies; (2) we prove that selecting update steps via prompt evidence admits a PAC-Bayes guarantee against overfitting; and (3) we characterize the Bayes-optimal update subspace under a linear-Gaussian correction model, yielding a scoring rule for selecting Transformer blocks and heads. Our theory helps explain the empirical instability of TTT, taking a step toward principled guidance for when, how far, and which directions to adapt.

Poster
Align Forward, Adapt Backward: Closing the Discretization Gap in Logic Gate Networks

Youngsung Kim

展开摘要

In neural network models, soft mixtures of fixed candidate components (e.g., logic gates and sub-networks) are often used during training for stable optimization, while hard selection is typically used at inference. This raises questions about training-inference mismatch. We analyze this gap by separating forward-pass computation (hard selection vs. soft mixture) from stochasticity (with vs. without Gumbel noise). Using logic gate networks as a testbed, we observe distinct behaviors across four methods: Hard-ST achieves zero selection gap by construction; Gumbel-ST achieves near-zero gap when training succeeds but suffers accuracy collapse at low temperatures; Soft-Mix achieves small gap only at low temperature via weight concentration; and Soft-Gumbel exhibits large gaps despite Gumbel noise, confirming that noise alone does not reduce the gap. We propose CAGE (Confidence-Adaptive Gradient Estimation) to maintain gradient flow while preserving forward alignment. On logic gate networks, Hard-ST and Gumbel-ST with CAGE both achieve over 98\% accuracy on MNIST and ${\sim}58\%$ on CIFAR-10; Hard-ST with CAGE further maintains zero selection gap across all temperatures by construction, while Gumbel-ST without CAGE suffers a ${\sim}47$-point accuracy collapse.

Poster
ContrastiveCFG: Guiding Diffusion Sampling by Contrasting Positive and Negative Concepts

Jinho Chang, Changsun Lee, Hyungjin Chung, Jong Chul Ye

展开摘要

As Classifier-Free Guidance (CFG) has proven effective in conditional diffusion model sampling for improved condition alignment, many applications use a negated CFG term as a Negative Prompting (NP) to filter out unwanted features from samples. However, simply negating CFG guidance creates an inverted probability distribution, often distorting samples away from the marginal distribution. Inspired by recent advances in conditional diffusion models for inverse problems, here we present a novel method to achieve guidance toward the given condition using contrastive loss. Specifically, our guidance term aligns or repels the denoising direction based on the given condition through contrastive loss, achieving a similar guiding effect to traditional CFG for positive conditions while overcoming the limitations of existing negative guidance methods. Experimental results demonstrate that our approach effectively injects or removes the given concepts while maintaining sample quality across diverse scenarios, from simple class conditions to complex and overlapping text prompts.

Poster
MalTree: Tracing Malware Evolution using Embeddings at Scale

Akash Amalan, Georgios SMARAGDAKIS, Tom Julian Viering

展开摘要

Malware detection remains largely reactive: machine learning models trained on known samples degrade as threats evolve. Understanding evolutionary relationships among malware families can inform proactive defense, but traditional reverse engineering can take months to years to uncover such lineage relationships. We propose MalTree, a framework that applies bioinformatics-inspired phylogenetic techniques (UPGMA and Neighbor-Joining) at scale to model malware evolution automatically using structural, behavioral, and image-based features. We introduce temporal validation using VirusTotal timestamps to assess whether inferred trees reflect actual evolutionary order. MalTree achieves 87% temporal consistency, indicating that inferred evolutionary relationships closely align with real-world emergence timelines. Our analysis shows that some families mutate over 10 times faster than others, suggesting that detection strategies should be tailored to family-specific evolutionary tempos. Case studies, including the Mirai botnet, confirm that inferred relationships from our phylogenetic tree align with documented threat intelligence. Our framework provides a foundation for shifting malware analysis from sample-by-sample classification toward lineage-aware evolutionary modeling.

Poster
SKETCH: Semantic Key-Point Conditioning for Long-Horizon Vessel Trajectory Prediction

Linyong Gan, Zimo Li, Wenxin Xu, Li Xingjian, Jianhua Z. Huang, Enmei Tu, Shuhang Chen

展开摘要

Accurate long-horizon vessel trajectory prediction remains challenging due to compounded uncertainty from complex navigation behaviors and environmental factors. Existing methods often struggle to maintain global directional consistency, leading to drifting or implausible trajectories when extrapolated over long time horizons. To address this issue, we propose a semantic-key-point-conditioned trajectory modeling framework, in which future trajectories are predicted by conditioning on a high-level Next Key Point (NKP) that captures navigational intent. This formulation decomposes long-horizon prediction into global semantic decision-making and local motion modeling, effectively restricting the support of future trajectories to semantically feasible subsets. To efficiently estimate the NKP prior from historical observations, we adopt a pretrain-finetune strategy. Extensive experiments on real-world AIS data demonstrate that the proposed method consistently outperforms state-of-the-art approaches, particularly for long travel durations, directional accuracy, and fine-grained trajectory prediction.

Poster
Uncovering the Gradient Geometry of Long CoT: A Spectral-guided Approach to Reasoning Distillation

Sinan Fan, Xiaofeng Sun, Chen Shen, Chenxi Huang, Shaotian Yan, Bing Wang, kaiyuan liu, Xiaosong Yuan, Liang Xie, Wenxiao Wang, Jun Zhang, Hongyang Chen, Jieping Ye

展开摘要

Large reasoning models (LRMs) achieve remarkable reasoning performance by generating long chains-of-thought (CoT). However, standard supervised fine-tuning (SFT) treats all tokens uniformly, indiscriminately minimizing loss across both essential reasoning steps and those that are noisy, redundant, or instance-specific. This often leads student models to memorize superficial patterns rather than acquire generalizable reasoning capabilities. To better understand this limitation, we introduce \textit{Loss Subspace Attribution}, a gradient decomposition analysis approach that uncovers a striking geometric structure: Gradients corresponding to effective reasoning predominantly lie within a low-rank consensus subspace, while conflicting or unstructured signals dominate the residual subspace. Guided by this insight, we propose \textbf{\textit{Spectral-guided Learning}}, a step-level distillation strategy that uses spectral strength to identify reasoning steps aligned with the consensus subspace and prioritizes their contribution to parameter updates, while suppressing gradients from the residual subspace. Experiments across various LRMs and diverse complex reasoning tasks consistently demonstrate that focusing optimization on the consensus subspace yields more robust and generalizable student models.

Poster