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 Overview


Multivariate Time Series Anomaly Detection with Idempotent Reconstruction

Neural Information Processing Systems

Reconstruction-based methods are competitive choices for multivariate time series anomaly detection (MTSAD). However, one challenge these methods may suffer is over generalization, where abnormal inputs are also well reconstructed. In addition, balancing robustness and sensitivity is also important for final performance, as robustness ensures accurate detection in potentially noisy data, while sensitivity enables early detection of subtle anomalies. To address these problems, inspired by idempotent generative network, we take the view from the manifold and propose a novel module named Idempotent Generation for Anomaly Detection (IGAD) which can be flexibly combined with a reconstruction-based method without introducing additional trainable parameters. We modify the manifold to make sure that normal time points can be mapped onto it while tightening it to drop out abnormal time points simultaneously. Regarding the latest findings of AD metrics, we evaluated IGAD on various methods with four realworld datasets, and they achieve visible improvements in VUS-PR than their predecessors, demonstrating the effective potential of IGAD for further improvements in MTSAD tasks. Our instructions on integrating IGAD into customized models and example codes are available at https://github.com/ProEcho1/


Ground-Compose-Reinforce: Grounding Language in Agentic Behaviours using Limited Data

Neural Information Processing Systems

Grounding language in perception and action is a key challenge when building situated agents that can interact with humans, or other agents, via language. In the past, addressing this challenge has required manually designing the language grounding or curating massive datasets that associate language with the environment. We propose Ground-Compose-Reinforce, an end-to-end, neurosymbolic framework for training RL agents directly from high-level task specifications-- without manually designed reward functions or other domain-specific oracles, and without massive datasets. These task specifications take the form of Reward Machines, automata-based representations that capture high-level task structure and are in some cases autoformalizable from natural language. Critically, we show that Reward Machines can be grounded using limited data by exploiting compositionality. Experiments in a custom Meta-World domain with only 350 labelled pretraining trajectories show that our framework faithfully elicits complex behaviours from high-level specifications--including behaviours that never appear in pretraining--while non-compositional approaches fail.


Dynamical Properties of Tokens in Self-Attention and Effects of Positional Encoding

Neural Information Processing Systems

This paper investigates the dynamical properties of tokens in pre-trained Transformer models and explores their application to improving Transformers. To this end, we analyze the dynamical system governing the continuous-time limit of the pre-trained model and characterize the asymptotic behavior of its solutions. Specifically, we characterize when tokens move closer to or farther from one another over time, depending on the model parameters. We provide sufficient conditions, based on these parameters, to identify scenarios where tokens either converge to zero or diverge to infinity. Unlike prior works, our conditions are broader in scope and more applicable to real-world models. Furthermore, we investigate how different forms of positional encoding - specifically absolute and rotary - affect these dynamical regimes. Empirical evidence reveals that the convergence scenario adversely impacts model performance. Motivated by these insights, we propose simple refinements to Transformer architectures that mitigate convergence behavior in models with absolute or rotary positional encoding. These findings support theoretical foundations and design principles for improving Transformer models.


Listwise Preference Diffusion Optimization for User Behavior Trajectories Prediction

Neural Information Processing Systems

Forecasting multi-step user behavior trajectories requires reasoning over structured preferences across future actions, a challenge overlooked by traditional sequential recommendation. This problem is critical for applications such as personalized commerce and adaptive content delivery, where anticipating a user's complete action sequence enhances both satisfaction and business outcomes. We identify an essential limitation of existing paradigms: their inability to capture global, listwise dependencies among sequence items. To address this, we formulate User Behavior Trajectory Prediction (UBTP) as a new task setting that explicitly models longterm user preferences. We introduce Listwise Preference Diffusion Optimization (LPDO), a diffusion-based training framework that directly optimizes structured preferences over entire item sequences. LPDO incorporates a Plackett-Luce supervision signal and derives a tight variational lower bound aligned with listwise ranking likelihoods, enabling coherent preference generation across denoising steps and overcoming the independent-token assumption of prior diffusion methods. To rigorously evaluate multi-step prediction quality, we propose the task-specific metric: Sequential Match (SeqMatch), which measures exact trajectory agreement, and adopt Perplexity (PPL), which assesses probabilistic fidelity. Extensive experiments on real-world user behavior benchmarks demonstrate that LPDO consistently outperforms state-of-the-art baselines, establishing a new benchmark for structured preference learning with diffusion models.


Steering Personalized Multilingual with Sparse

Neural Information Processing Systems

Watermarking LLM-generated text is critical for content attribution and misinformation prevention, yet existing methods compromise text quality and require white-box model access with logit manipulation or training, which exclude APIbased models and multilingual scenarios. We propose SAEMARK, an inferencetime framework for multi-bit watermarking that embeds personalized information through feature-based rejection sampling, fundamentally different from logit-based or rewriting-based approaches: we do not modify model outputs directly and require only black-box access, while naturally supporting multi-bit message embedding and generalizing across diverse languages and domains. We instantiate the framework using Sparse Autoencoders as deterministic feature extractors and provide theoretical worst-case analysis relating watermark accuracy to computational budget. Experiments across 4 datasets demonstrate strong watermarking performance on English, Chinese, and code while preserving text quality. SAEMARK establishes a new paradigm for scalable, quality-preserving watermarks that work seamlessly with closed-source LLMs across languages and domains.


Solver-Free Decision-Focused Learning for Linear Optimization Problems

Neural Information Processing Systems

Mathematical optimization is a fundamental tool for decision-making in a wide range of applications. However, in many real-world scenarios, the parameters of the optimization problem are not known a priori and must be predicted from contextual features. This gives rise to predict-then-optimize problems, where a machine learning model predicts problem parameters that are then used to make decisions via optimization. A growing body of work on decision-focused learning (DFL) addresses this setting by training models specifically to produce predictions that maximize downstream decision quality, rather than accuracy. While effective, DFL is computationally expensive, because it requires solving the optimization problem with the predicted parameters at each loss evaluation.


LongVPO: From Anchored Cues to Self-Reasoning for Long-Form Video Preference Optimization

Neural Information Processing Systems

We present LongVPO, a novel two-stage Direct Preference Optimization framework that enables short-context vision-language models to robustly understand ultra-long videos without any long-video annotations. In Stage 1, we synthesize preference triples by anchoring questions to individual short clips, interleaving them with distractors, and applying visual-similarity and question-specificity filtering to mitigate positional bias and ensure unambiguous supervision.


DMol: AHighly Efficient and Chemical Motif-Preserving Molecule Generation Platform

Neural Information Processing Systems

We introduce a new graph diffusion model for small drug molecule generation which simultaneously offers a 10-fold reduction in the number of diffusion steps when compared to existing methods, preservation of small molecule graph motifs via motif compression, and an average 3% improvement in SMILES validity over the DiGress model across all real-world molecule benchmarking datasets. Furthermore, our approach outperforms the state-of-the-art DeFoG method with respect to motif-conservation by roughly 4%, as evidenced by high ChEMBLlikeness, QED and newly introduced shingles distance scores. The key ideas behind the approach are to use a combination of deterministic and random subgraph perturbations, so that the node and edge noise schedules are codependent; to modify the loss function of the training process in order to exploit the deterministic component of the schedule; and, to "compress" a collection of highly relevant carbon ring and other motif structures into supernodes in a way that allows for simple subsequent integration into the molecular scaffold1.


Virus Infection Attack on LLMs: Your Poisoning Can Spread "VIA " Synthetic Data

Neural Information Processing Systems

Synthetic data refers to artificial samples generated by models. While it has been validated to significantly enhance the performance of large language models (LLMs) during training and has been widely adopted in LLM development, potential security risks it may introduce remain uninvestigated. This paper systematically evaluates the resilience of synthetic-data-integrated training paradigm for LLMs against mainstream poisoning and backdoor attacks. We reveal that such a paradigm exhibits strong resistance to existing attacks, primarily thanks to the different distribution patterns between poisoning data and queries used to generate synthetic samples. To enhance the effectiveness of these attacks and further investigate the security risks introduced by synthetic data, we introduce a novel and universal attack framework, namely, Virus Infection Attack (VIA), which enables the propagation of current attacks through synthetic data even under purely clean queries. Inspired by the principles of virus design in cybersecurity, VIA conceals the poisoning payload within a protective "shell" and strategically searches for optimal hijacking points in benign samples to maximize the likelihood of generating malicious content. Extensive experiments on both data poisoning and backdoor attacks show that VIA significantly increases the presence of poisoning content in synthetic data and correspondingly raises the attack success rate (ASR) on downstream models to levels comparable to those observed in the poisoned upstream models.


FreshStack: Building Realistic Benchmarks for Evaluating Retrieval on Technical Documents

Neural Information Processing Systems

We introduce FreshStack, a holistic framework for automatically building information retrieval (IR) evaluation benchmarks by incorporating challenging questions and answers. FreshStack conducts the following steps: (1) automatic corpus collection from code and technical documentation, (2) nugget generation from community-asked questions and answers, and (3) nugget-level support, retrieving documents using a fusion of retrieval techniques and hybrid architectures. We use FreshStack to build five datasets on fast-growing, recent, and niche domains to ensure the tasks are sufficiently challenging. On FreshStack, existing retrieval models, when applied out-of-the-box, significantly underperform oracle approaches on all five domains, denoting plenty of headroom to improve IR quality. In addition, we identify cases where rerankers do not improve first-stage retrieval accuracy (two out of five domains) and oracle context helps an LLM generator generate a high-quality RAG answer. We hope FreshStack will facilitate future work toward constructing realistic, scalable, and uncontaminated IR and RAG evaluation benchmarks.