OpenRaiser/Intern-Atlas huggingface dataset:
Unlearned but Not Forgotten: Data Extraction after Exact Unlearning in LLM
Venue: Conference NeurIPS 2025
Year: 2025

Large Language Models are typically trained on datasets collected from the web, which may inadvertently contain harmful or sensitive personal information. To address growing privacy concerns, unlearning methods have been proposed to remove the influence of specific data from trained models. Of these, exact unlearning -- which retrains the model from scratch without the target data -- is widely regarded the gold standard for mitigating privacy risks in deployment. In this paper, we revisit this assumption in a practical deployment setting where both the pre- and post-unlearning logits API are exposed, such as in open-weight scenarios. Targeting this setting, we introduce a novel data extraction attack that leverages signals from the pre-unlearning model to guide the post-unlearning model, uncovering patterns that reflect the removed data distribution. Combining model guidance with a token filtering strategy, our attack significantly improves extraction success rates -- doubling performance in some cases -- across common benchmarks such as MUSE, TOFU, and WMDP. Furthermore, we demonstrate our attack's effectiveness on a simulated medical diagnosis dataset to highlight real-world privacy risks associated with exact unlearning. In light of our findings, which suggest that unlearning may, in a contradictory way, increase the risk of privacy leakage during real-world deployments, we advocate for evaluation of unlearning methods to consider broader threat models that account not only for post-unlearning models but also for adversarial access to prior checkpoints. Code is publicly available at: https://github.com/Nicholas0228/unlearned_data_extraction_llm.
Dynamic Bundling with Large Language Models for Zero-Shot Inference on Text-Attributed Graphs
Venue: Conference NeurIPS 2025
Year: 2025

Large language models (LLMs) have been used in many zero-shot learning problems, with their strong generalization ability. Recently, adopting LLMs in text-attributed graphs (TAGs) has drawn increasing attention. However, the adoption of LLMs faces two major challenges: limited information on graph structure and unreliable responses. LLMs struggle with text attributes isolated from the graph topology. Worse still, they yield unreliable predictions due to both information insufficiency and the inherent weakness of LLMs (e.g., hallucination). Towards this end, this paper proposes a novel method named Dynamic Text Bundling Supervision (DENSE) that queries LLMs with bundles of texts to obtain bundle-level labels and uses these labels to supervise graph neural networks. Specifically, we sample a set of bundles, each containing a set of nodes with corresponding texts of close proximity. We then query LLMs with the bundled texts to obtain the label of each bundle. Subsequently, the bundle labels are used to supervise the optimization of graph neural networks, and the bundles are further refined to exclude noisy items. To justify our design, we also provide theoretical analysis of the proposed method. Extensive experiments across ten datasets validate the effectiveness of the proposed method.
Gradient Variance Reveals Failure Modes in Flow-Based Generative Models
Venue: Conference NeurIPS 2025
Year: 2025

Rectified Flows learn ODE vector fields whose trajectories are straight between source and target distributions, enabling near one-step inference. We show that this straight-path objective conceals fundamental failure modes: under deterministic training, low gradient variance drives memorization of arbitrary training pairings, even when interpolant lines between pairs intersect. To analyze this mechanism, we study Gaussian-to-Gaussian transport and use the loss gradient variance across stochastic and deterministic regimes to characterize which vector fields optimization favors in each setting. We then show that, in a setting where all interpolating lines intersect, applying Rectified Flow yields the same specific pairings at inference as during training. More generally, we prove that a memorizing vector field exists even when training interpolants intersect, and that optimizing the straight-path objective converges to this ill-defined field. At inference, deterministic integration reproduces the exact training pairings. We validate our findings empirically on the CelebA dataset, confirming that deterministic interpolants induce memorization, while the injection of small noise restores generalization.
Retrosynthesis Planning via Worst-path Policy Optimisation in Tree-structured MDPs
Venue: Conference NeurIPS 2025
Year: 2025

Retrosynthesis planning aims to decompose target molecules into available building blocks, forming a synthetic tree where each internal node represents an intermediate compound and each leaf ideally corresponds to a purchasable reactant. However, this tree becomes invalid if any leaf node is not a valid building block, making the planning process vulnerable to the "weakest link" in the synthetic route. Existing methods often optimise for average performance across branches, failing to account for this worst-case sensitivity. In this paper, we reframe retrosynthesis as a worst-path optimisation problem within tree-structured Markov Decision Processes (MDPs). We prove that this formulation admits a unique optimal solution and provides monotonic improvement guarantees. Building on this insight, we introduce Interactive Retrosynthesis Planning (InterRetro), a method that interacts with the tree MDP, learns a value function for worst-path outcomes, and improves its policy through self-imitation, preferentially reinforcing past decisions with high estimated advantage. Empirically, InterRetro achieves state-of-the-art results - solving 100% of targets on the Retro*-190 benchmark, shortening synthetic routes by 4.9%, and achieving promising performance using only 10% of the training data.
On scalable and efficient training of diffusion samplers
Venue: Conference NeurIPS 2025
Year: 2025

We address the challenge of training diffusion models to sample from unnormalized energy distributions in the absence of data, the so-called diffusion samplers. Although these approaches have shown promise, they struggle to scale in more demanding scenarios where energy evaluations are expensive and the sampling space is high-dimensional. To address this limitation, we propose a scalable and sample-efficient framework that properly harmonizes the powerful classical sampling method and the diffusion sampler. Specifically, we utilize Monte Carlo Markov chain (MCMC) samplers with a novelty-based auxiliary energy as a Searcher to collect off-policy samples, using an auxiliary energy function to compensate for exploring modes the diffusion sampler rarely visits. These off-policy samples are then combined with on-policy data to train the diffusion sampler, thereby expanding its coverage of the energy landscape. Furthermore, we identify primacy bias, i.e., the preference of samplers for early experience during training, as the main cause of mode collapse during training, and introduce a periodic re-initialization trick to resolve this issue. Our method significantly improves sample efficiency on standard benchmarks for diffusion samplers and also excels at higher-dimensional problems and real-world molecular conformer generation.
Irrational Complex Rotations Empower Low-bit Optimizers
Venue: Conference NeurIPS 2025
Year: 2025

In this paper, we propose a novel optimizer state compression algorithm, namely $π$-Quant, which leverages the properties of irrational numbers (e.g., $π$) for memory-efficient training. The core idea is based on our mathematical findings, which show that a pair of parameters can be represented by a single rotation angle using the complex rotation scheme. Building on this insight, we map the parameters into a complex space and perform quantization using the corresponding rotation angles. To efficiently integrate it into optimization process, we develop an efficient system of geometric equations that computes the precise rotation angles with linear complexity. We evaluate $π$-Quant on a wide range of tasks. Our experiments show that it can reduce the bit-width of parameters to 3.32-bit, achieving a 75% reduction in parameter scale and a 40% decrease in GPU memory usage, all while maintaining full accuracy.
Text to Sketch Generation with Multi-Styles
Venue: Conference NeurIPS 2025
Year: 2025

Recent advances in vision-language models have facilitated progress in sketch generation. However, existing specialized methods primarily focus on generic synthesis and lack mechanisms for precise control over sketch styles. In this work, we propose a training-free framework based on diffusion models that enables explicit style guidance via textual prompts and referenced style sketches. Unlike previous style transfer methods that overwrite key and value matrices in self-attention, we incorporate the reference features as auxiliary information with linear smoothing and leverage a style-content guidance mechanism. This design effectively reduces content leakage from reference sketches and enhances synthesis quality, especially in cases with low structural similarity between reference and target sketches. Furthermore, we extend our framework to support controllable multi-style generation by integrating features from multiple reference sketches, coordinated via a joint AdaIN module. Extensive experiments demonstrate that our approach achieves high-quality sketch generation with accurate style alignment and improved flexibility in style control. The official implementation of M3S is available at https://github.com/CMACH508/M3S.
DenoiseRotator: Enhance Pruning Robustness for LLMs via Importance Concentration
Venue: Conference NeurIPS 2025
Year: 2025

Pruning is a widely used technique to compress large language models (LLMs) by removing unimportant weights, but it often suffers from significant performance degradation - especially under semi-structured sparsity constraints. Existing pruning methods primarily focus on estimating the importance of individual weights, which limits their ability to preserve critical capabilities of the model. In this work, we propose a new perspective: rather than merely selecting which weights to prune, we first redistribute parameter importance to make the model inherently more amenable to pruning. By minimizing the information entropy of normalized importance scores, our approach concentrates importance onto a smaller subset of weights, thereby enhancing pruning robustness. We instantiate this idea through DenoiseRotator, which applies learnable orthogonal transformations to the model's weight matrices. Our method can be seamlessly integrated with existing pruning techniques such as Magnitude, SparseGPT, and Wanda. Evaluated on LLaMA3, Qwen2.5, and Mistral models under 50% unstructured and 2:4 semi-structured sparsity, DenoiseRotator consistently improves perplexity and zero-shot accuracy. For instance, on LLaMA3-70B pruned with SparseGPT at 2:4 semi-structured sparsity, DenoiseRotator reduces the perplexity gap to the dense model by 58%, narrowing the degradation from 8.1 to 3.4 points. Codes are available at https://github.com/Axel-gu/DenoiseRotator.
Hallucination at a Glance: Controlled Visual Edits and Fine-Grained Multimodal Learning
Venue: Conference NeurIPS 2025
Year: 2025

Multimodal large language models (MLLMs) have achieved strong performance on vision-language tasks but still struggle with fine-grained visual differences, leading to hallucinations or missed semantic shifts. We attribute this to limitations in both training data and learning objectives. To address these issues, we propose a controlled data generation pipeline that produces minimally edited image pairs with semantically aligned captions. Using this pipeline, we construct the Micro Edit Dataset (MED), containing over 50K image-text pairs spanning 11 fine-grained edit categories, including attribute, count, position, and object presence changes. Building on MED, we introduce a supervised fine-tuning (SFT) framework with a feature-level consistency loss that promotes stable visual embeddings under small edits. We evaluate our approach on the Micro Edit Detection benchmark, which includes carefully balanced evaluation pairs designed to test sensitivity to subtle visual variations across the same edit categories. Our method improves difference detection accuracy and reduces hallucinations compared to strong baselines, including GPT-4o. Moreover, it yields consistent gains on standard vision-language tasks such as image captioning and visual question answering. These results demonstrate the effectiveness of combining targeted data and alignment objectives for enhancing fine-grained visual reasoning in MLLMs.
Multi-step Visual Reasoning with Visual Tokens Scaling and Verification
Venue: Conference NeurIPS 2025
Year: 2025

Multi-modal large language models (MLLMs) have achieved remarkable capabilities by integrating visual perception with language understanding, enabling applications such as image-grounded dialogue, visual question answering, and scientific analysis. However, most MLLMs adopt a static inference paradigm, encoding the entire image into fixed visual tokens upfront, which limits their ability to iteratively refine understanding or adapt to context during inference. This contrasts sharply with human perception, which is dynamic, selective, and feedback-driven. In this work, we introduce a novel framework for inference-time visual token scaling that enables MLLMs to perform iterative, verifier-guided reasoning over visual content. We formulate the problem as a Markov Decision Process, involving a reasoner that proposes visual actions and a verifier, which is trained via multi-step Direct Preference Optimization (DPO), that evaluates these actions and determines when reasoning should terminate. To support this, we present a new dataset, VTS, comprising supervised reasoning trajectories (VTS-SFT) and preference-labeled reasoning comparisons (VTS-DPO). Our method significantly outperforms existing approaches across diverse visual reasoning benchmarks, offering not only improved accuracy but also more interpretable and grounded reasoning processes. These results demonstrate the promise of dynamic inference mechanisms for enabling fine-grained, context-aware visual reasoning in next-generation MLLMs.
Think before Recommendation: Autonomous Reasoning-enhanced Recommender
Venue: Conference NeurIPS 2025
Year: 2025

The core task of recommender systems is to learn user preferences from historical user-item interactions. With the rapid development of large language models (LLMs), recent research has explored leveraging the reasoning capabilities of LLMs to enhance rating prediction tasks. However, existing distillation-based methods suffer from limitations such as the teacher model's insufficient recommendation capability, costly and static supervision, and superficial transfer of reasoning ability. To address these issues, this paper proposes RecZero, a reinforcement learning (RL)-based recommendation paradigm that abandons the traditional multi-model and multi-stage distillation approach. Instead, RecZero trains a single LLM through pure RL to autonomously develop reasoning capabilities for rating prediction. RecZero consists of two key components: (1) "Think-before-Recommendation" prompt construction, which employs a structured reasoning template to guide the model in step-wise analysis of user interests, item features, and user-item compatibility; and (2) rule-based reward modeling, which adopts group relative policy optimization (GRPO) to compute rewards for reasoning trajectories and optimize the LLM. Additionally, the paper explores a hybrid paradigm, RecOne, which combines supervised fine-tuning with RL, initializing the model with cold-start reasoning samples and further optimizing it with RL. Experimental results demonstrate that RecZero and RecOne significantly outperform existing baseline methods on multiple benchmark datasets, validating the superiority of the RL paradigm in achieving autonomous reasoning-enhanced recommender systems.
MEgoHand: Multimodal Egocentric Hand-Object Interaction Motion Generation
Venue: Conference NeurIPS 2025
Year: 2025

Egocentric hand-object motion generation is crucial for immersive AR/VR and robotic imitation but remains challenging due to unstable viewpoints, self-occlusions, perspective distortion, and noisy ego-motion. Existing methods rely on predefined 3D object priors, limiting generalization to novel objects, which restricts their generalizability to novel objects. Meanwhile, recent multimodal approaches suffer from ambiguous generation from abstract textual cues, intricate pipelines for modeling 3D hand-object correlation, and compounding errors in open-loop prediction. We propose MEgoHand, a multimodal framework that synthesizes physically plausible hand-object interactions from egocentric RGB, text, and initial hand pose. MEgoHand introduces a bi-level architecture: a high-level "cerebrum" leverages a vision language model (VLM) to infer motion priors from visual-textual context and a monocular depth estimator for object-agnostic spatial reasoning, while a low-level DiT-based flow-matching policy generates fine-grained trajectories with temporal orthogonal filtering to enhance stability. To address dataset inconsistency, we design a dataset curation paradigm with an Inverse MANO Retargeting Network and Virtual RGB-D Renderer, curating a unified dataset of 3.35M RGB-D frames, 24K interactions, and 1.2K objects. Extensive experiments across five in-domain and two cross-domain datasets demonstrate the effectiveness of MEgoHand, achieving substantial reductions in wrist translation error (86.9%) and joint rotation error (34.1%), highlighting its capacity to accurately model fine-grained hand joint structures and generalize robustly across diverse scenarios.
Bisecle: Binding and Separation in Continual Learning for Video Language Understanding
Venue: Conference NeurIPS 2025
Year: 2025

Frontier vision-language models (VLMs) have made remarkable improvements in video understanding tasks. However, real-world videos typically exist as continuously evolving data streams (e.g., dynamic scenes captured by wearable glasses), necessitating models to continually adapt to shifting data distributions and novel scenarios. Considering the prohibitive computational costs of fine-tuning models on new tasks, usually, a small subset of parameters is updated while the bulk of the model remains frozen. This poses new challenges to existing continual learning frameworks in the context of large multimodal foundation models, i.e., catastrophic forgetting and update conflict. While the foundation models struggle with parameter-efficient continual learning, the hippocampus in the human brain has evolved highly efficient mechanisms for memory formation and consolidation. Inspired by the rapid Binding and pattern separation mechanisms in the hippocampus, in this work, we propose Bisecle for video-language continual learning, where a multi-directional supervision module is used to capture more cross-modal relationships and a contrastive prompt learning scheme is designed to isolate task-specific knowledge to facilitate efficient memory storage. Binding and separation processes further strengthen the ability of VLMs to retain complex experiences, enabling robust and efficient continual learning in video understanding tasks. We perform a thorough evaluation of the proposed Bisecle, demonstrating its ability to mitigate forgetting and enhance cross-task generalization on several VideoQA benchmarks.
On Linear Mode Connectivity of Mixture-of-Experts Architectures
Venue: Conference NeurIPS 2025
Year: 2025

Linear Mode Connectivity (LMC) is a notable phenomenon in the loss landscapes of neural networks, wherein independently trained models have been observed to be connected--up to permutation symmetries--by linear paths in parameter space along which the loss remains consistently low. This observation challenges classical views of non-convex optimization and has implications for model ensembling, generalization, and our understanding of neural loss geometry. Inspired by recent studies on LMC in standard neural networks, we systematically investigate this phenomenon within Mixture-of-Experts (MoE) architectures--a class of models known for their scalability and computational efficiency, which combine traditional neural networks--referred to as experts--through a learnable gating mechanism. We begin by conducting a comprehensive analysis of both dense and sparse gating regimes, demonstrating that the symmetries inherent to MoE architectures are fully characterized by permutations acting on both the expert components and the gating function. Building on these foundational findings, we propose a matching algorithm that enables alignment between independently trained MoEs, thereby facilitating the discovery of LMC. Finally, we empirically validate the presence of LMC using our proposed algorithm across diverse MoE configurations--including dense, sparse, and shared-expert variants--under a wide range of model settings and datasets of varying scales and modalities. Our results confirm the existence of LMC in MoE architectures and offer fundamental insights into the functional landscape and optimization dynamics of deep learning models.
Where and How to Perturb: On the Design of Perturbation Guidance in Diffusion and Flow Models
Venue: Conference NeurIPS 2025
Year: 2025

Recent guidance methods in diffusion models steer reverse sampling by perturbing the model to construct an implicit weak model and guide generation away from it. Among these approaches, attention perturbation has demonstrated strong empirical performance in unconditional scenarios where classifier-free guidance is not applicable. However, existing attention perturbation methods lack principled approaches for determining where perturbations should be applied, particularly in Diffusion Transformer (DiT) architectures where quality-relevant computations are distributed across layers. In this paper, we investigate the granularity of attention perturbations, ranging from the layer level down to individual attention heads, and discover that specific heads govern distinct visual concepts such as structure, style, and texture quality. Building on this insight, we propose "HeadHunter", a systematic framework for iteratively selecting attention heads that align with user-centric objectives, enabling fine-grained control over generation quality and visual attributes. In addition, we introduce SoftPAG, which linearly interpolates each selected head's attention map toward an identity matrix, providing a continuous knob to tune perturbation strength and suppress artifacts. Our approach not only mitigates the oversmoothing issues of existing layer-level perturbation but also enables targeted manipulation of specific visual styles through compositional head selection. We validate our method on modern large-scale DiT-based text-to-image models including Stable Diffusion 3 and FLUX.1, demonstrating superior performance in both general quality enhancement and style-specific guidance. Our work provides the first head-level analysis of attention perturbation in diffusion models, uncovering interpretable specialization within attention layers and enabling practical design of effective perturbation strategies.