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We introduce a new interpretation of the attention matrix as a discrete-time Markov chain. Our interpretation sheds light on common operations involving attention scores such as selection, summation, and averaging in a unified framework. It further extends them by considering indirect attention, propagated through the Markov chain, as opposed to previous studies that only model immediate effects. Our key observation is that tokens linked to semantically similar regions form metastable states, i.e., regions where attention tends to concentrate, while noisy attention scores dissipate. Metastable states and their prevalence can be easily computed through simple matrix multiplication and eigenanalysis, respectively. Using these lightweight tools, we demonstrate state-of-the-art zero-shot segmentation. Lastly, we define TokenRank---the steady state vector of the Markov chain, which measures global token importance. We show that TokenRank enhances unconditional image generation, improving both quality (IS) and diversity (FID), and can also be incorporated into existing segmentation techniques to improve their performance over existing benchmarks. We believe our framework offers a fresh view of how tokens are being attended in modern visual transformers.

It has been shown that the chain of thought (CoT) can enhance the power of LLMs to simulate a Turing machine or an algorithm, and in particular its mathematical reasoning ability. The memorization capability of LLMs is an important aspect of their expressive ability, which offers valuable insight into designing models with enhanced generalization potential. Currently, the optimal memorization capacities of transformers have been established for both the general dataset and the dataset that satisfies a specific separability condition. However, the question of whether the CoT can improve the memorization capability of LLMs remains unexamined. To fill this gap, we establish the memorization capability for fixed-precision autoregressive transformers with or without CoT. Precisely, we first give the necessary and sufficient conditions for transformers to memorize a finite language and then provide the upper and lower bounds for the number of parameters of the memorization transformers. Our result indicates that the classes of languages that can be memorized by transformers with or without CoT do not contain each other, and the same number of parameters is needed for transformers with or without CoT to memorize, implying that CoT does not enhance a transformer’s memorization power significantly. We further show that CoT can not help transformers to memory certain infinite languages.

In this paper, we propose a novel learning paradigm, termed *Chain-of-Model* (CoM), which incorporates the causal relationship into the hidden states of each layer as a chain style. thereby introducing great scaling efficiency in model training and inference flexibility in deployment.We introduce the concept of *Chain-of-Representation* (CoR), which formulates the hidden states at each layer as a combination of multiple sub-representations (i.e., chains). In each layer, each chain from the output representations can only view all of its preceding chains in the input representations. Consequently, the model built upon CoM framework can progressively scale up the model size by increasing the chains based on the previous models (i.e., chains), and offer multiple sub-models at varying sizes for elastic inference by using different chain numbers. Based on this principle, we devise *Chain-of-Language-Model* (CoLM), which incorporates the idea of CoM into each layer of Transformer architecture. Based on CoLM, we further introduce CoLM-Air by introducing a *KV sharing* mechanism, that computes all keys and values within the first chain and then shares across all chains. This design demonstrates additional extensibility, such as enabling seamless LM switching, prefilling acceleration and so on. Experimental results demonstrate our CoLM family can achieve comparable performance to the standard Transformer, while simultaneously enabling greater flexiblity, such as progressive scaling to improve training efficiency and offer multiple varying model sizes for elastic inference, paving a a new way toward building language models.

Large Language Models (LLMs) have demonstrated remarkable performance in many applications, including challenging reasoning problems via chain-of-thought (CoT) techniques that generate ``thinking tokens'' before answering the questions. While existing theoretical works demonstrate that CoT with discrete tokens boosts the capability of LLMs, recent work on continuous CoT lacks a theoretical understanding of why it outperforms discrete counterparts in various reasoning tasks, such as directed graph reachability, a fundamental graph reasoning problem that includes many practical domain applications as special cases. In this paper, we prove that a two-layer transformer with $D$ steps of continuous CoT can solve the directed graph reachability problem, where $D$ is the diameter of the graph, while the best known result of constant-depth transformers with discrete CoT requires $O(n^2)$ decoding steps where $n$ is the number of vertices ($D<n$). In our construction, each continuous thought vector is a superposition state that encodes multiple search frontiers simultaneously (i.e., parallel breadth-first search (BFS)), while discrete CoT must choose a single path sampled from the superposition state, which leads to a sequential search that requires many more steps and may be trapped in local solutions. We also performed extensive experiments to verify that our theoretical construction aligns well with the empirical solution obtained via training dynamics. Notably, encoding of multiple search frontiers as a superposition state automatically emerges in training continuous CoT, without explicit supervision to guide the model to explore multiple paths simultaneously.

Learning complex functions that involve multi-step reasoning poses a significant challenge for standard supervised learning from input-output examples. Chain-of-thought (CoT) supervision, which augments training data with intermediate reasoning steps to provide a richer learning signal, has driven recent advances in large language model reasoning. This paper develops a statistical theory of learning under CoT supervision. Central to the theory is the *CoT information*, which measures the additional discriminative power offered by the chain-of-thought for distinguishing hypotheses with different end-to-end behaviors. The main theoretical results demonstrate how CoT supervision can yield significantly faster learning rates compared to standard end-to-end supervision, with both upper bounds and information-theoretic lower bounds characterized by the CoT information.

Recent deep clustering models have produced impressive clustering performance. However, a common issue with existing methods is the disparity between global and local feature structures. While local structures typically show strong consistency and compactness within class samples, global features often present intertwined boundaries and poorly separated clusters. Motivated by this observation, we propose **DCBoost, a parameter-free plug-in** designed to enhance the global feature structures of current deep clustering models. By harnessing reliable local structural cues, our method aims to elevate clustering performance effectively. Specifically, we first identify high-confidence samples through adaptive $k$-nearest neighbors-based consistency filtering, aiming to select a sufficient number of samples with high label reliability to serve as trustworthy anchors for self-supervision. Subsequently, these samples are utilized to compute a discriminative loss, which promotes both intra-class compactness and inter-class separability, to guide network optimization. Extensive experiments across various benchmark datasets showcase that our DCBoost significantly improves the clustering performance of diverse existing deep clustering models. Notably, our method improves the performance of current state-of-the-art baselines (e.g., ProPos) by more than 3\% and amplifies the silhouette coefficient by over $7\times$. **Code is available at [https://github.com/l-h-y168/DCBoost](https://github.com/l-h-y168/DCBoost).**

Inference-time computation has emerged as a promising scaling axis for improving large language model reasoning. However, despite yielding impressive performance, the optimal allocation of inference-time computation remains poorly understood. A central question is whether to prioritize sequential scaling (e.g., longer chains of thought) or parallel scaling (e.g., majority voting across multiple short chains of thought). In this work, we seek to illuminate the landscape of test-time scaling by demonstrating the existence of reasoning settings where sequential scaling offers an exponential advantage over parallel scaling. These settings are based on graph connectivity problems in challenging distributions of graphs. We validate our theoretical findings with comprehensive experiments across a range of language models, including models trained from scratch for graph connectivity with different chain of thought strategies as well as large reasoning models.

Securing software supply chains is a growing challenge due to the inadequacy of existing datasets in capturing the complexity of next-gen attacks, such as multiphase malware execution, remote access activation, and dynamic payload generation. Existing datasets, which rely on metadata inspection and static code analysis, are inadequate for detecting such attacks. This creates a critical gap because these datasets do not capture what happens during and after a package is installed. To address this gap, we present QUT-DV25, a dynamic analysis dataset specifically designed to support and advance research on detecting and mitigating supply chain attacks within the Python Package Index (PyPI) ecosystem. This dataset captures install and post-install-time traces from 14,271 Python packages, of which 7,127 are malicious. The packages are executed in an isolated sandbox environment using an extended Berkeley Packet Filter (eBPF) kernel and user-level probes. It captures 36 real-time features, that includes system calls, network traffic, resource usages, directory access patterns, dependency logs, and installation behaviors, enabling the study of next-gen attack vectors. ML analysis using the QUT-DV25 dataset identified four malicious PyPI packages previously labeled as benign, each with thousands of downloads. These packages deployed covert remote access and multi-phase payloads, were reported to PyPI maintainers, and subsequently removed. This highlights the practical value of QUT-DV25, as it outperforms reactive, metadata, and static datasets, offering a robust foundation for developing and benchmarking advanced threat detection within the evolving software supply chain ecosystem.