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The increasing capability of large language models (LLMs) to generate fluent long-form texts is presenting new challenges in distinguishing machine-generated outputs from human-written ones, which is crucial for ensuring authenticity and…

Computation and Language · Computer Science 2024-10-08 Yufei Tian , Zeyu Pan , Nanyun Peng

Transformers generate valid and diverse chemical structures, but little is known about the mechanisms that enable these models to capture the rules of molecular representation. We present a mechanistic analysis of autoregressive…

Machine Learning · Computer Science 2025-12-11 Kristof Varadi , Mark Marosi , Peter Antal

Because language is creative, any reasonable language model must generalize, deciding what to say in novel contexts by using information from similar contexts. But what about contexts that are not novel but merely infrequent? In…

Computation and Language · Computer Science 2026-02-05 Vsevolod Kapatsinski

Despite overwhelming achievements in recognition accuracy, extending an open-set capability -- ability to identify when the question is out of scope -- remains greatly challenging in a scalable machine learning inference. A recent research…

Machine Learning · Computer Science 2021-11-01 Pisit Nakjai , Jiradej Ponsawat , Tatpong Katanyukul

We conjecture that hidden state vectors corresponding to individual input tokens encode information sufficient to accurately predict several tokens ahead. More concretely, in this paper we ask: Given a hidden (internal) representation of a…

Computation and Language · Computer Science 2024-03-14 Koyena Pal , Jiuding Sun , Andrew Yuan , Byron C. Wallace , David Bau

The ability of learning useful features is one of the major advantages of neural networks. Although recent works show that neural network can operate in a neural tangent kernel (NTK) regime that does not allow feature learning, many works…

Machine Learning · Computer Science 2024-11-06 Mo Zhou , Rong Ge

Pretraining plays a pivotal role in acquiring generalized knowledge from large-scale data, achieving remarkable successes as evidenced by large models in CV and NLP. However, progress in the graph domain remains limited due to fundamental…

Artificial Intelligence · Computer Science 2024-06-21 Yu Song , Haitao Mao , Jiachen Xiao , Jingzhe Liu , Zhikai Chen , Wei Jin , Carl Yang , Jiliang Tang , Hui Liu

Planning is a crucial element of both human intelligence and contemporary large language models (LLMs). In this paper, we initiate a theoretical investigation into the emergence of planning capabilities in Transformer-based LLMs via their…

Machine Learning · Computer Science 2024-11-12 Siwei Wang , Yifei Shen , Shi Feng , Haoran Sun , Shang-Hua Teng , Wei Chen

Increase in data, size, or compute can lead to sudden learning of specific capabilities by a neural network -- a phenomenon often called "emergence''. Beyond scientific understanding, establishing the causal factors underlying such emergent…

Machine Learning · Computer Science 2024-09-10 Ekdeep Singh Lubana , Kyogo Kawaguchi , Robert P. Dick , Hidenori Tanaka

Kernels are often developed and used as implicit mapping functions that show impressive predictive power due to their high-dimensional feature space representations. In this study, we gradually construct a series of simple feature maps that…

Machine Learning · Computer Science 2020-07-20 Gurhan Ceylan , S. Ilker Birbil

Large language models such as GPT and Llama are trained with a next-token prediction loss. In this work, we suggest that training language models to predict multiple future tokens at once results in higher sample efficiency. More…

Computation and Language · Computer Science 2024-05-01 Fabian Gloeckle , Badr Youbi Idrissi , Baptiste Rozière , David Lopez-Paz , Gabriel Synnaeve

The Transformer model has a tendency to overfit various aspects of the training data, such as the overall sequence length. We study elementary string edit functions using a defined set of error indicators to interpret the behaviour of the…

Machine Learning · Computer Science 2024-10-18 Patrik Zavoral , Dušan Variš , Ondřej Bojar

Despite the growing use of transformer models in computer vision, a mechanistic understanding of these networks is still needed. This work introduces a method to reverse-engineer Vision Transformers trained to solve image classification…

Computer Vision and Pattern Recognition · Computer Science 2023-10-31 Martina G. Vilas , Timothy Schaumlöffel , Gemma Roig

In computational reinforcement learning, a growing body of work seeks to construct an agent's perception of the world through predictions of future sensations; predictions about environment observations are used as additional input features…

Machine Learning · Computer Science 2022-06-15 Alexandra Kearney , Anna Koop , Johannes Günther , Patrick M. Pilarski

The Transformer architecture has become prominent in developing large causal language models. However, mechanisms to explain its capabilities are not well understood. Focused on the training process, here we establish a meta-learning view…

Machine Learning · Computer Science 2024-03-26 Xinbo Wu , Lav R. Varshney

Transformer-based models generate hidden states that are difficult to interpret. In this work, we analyze hidden states and modify them at inference, with a focus on motion forecasting. We use linear probing to analyze whether interpretable…

Machine Learning · Computer Science 2025-05-19 Omer Sahin Tas , Royden Wagner

Transformers may exhibit two-stage training dynamics during the real-world training process. For instance, when training GPT-2 on the Counterfact dataset, the answers progress from syntactically incorrect to syntactically correct to…

Computation and Language · Computer Science 2025-10-14 Zixuan Gong , Shijia Li , Yong Liu , Jiaye Teng

Standard evaluations of Large language models (LLMs) focus on task performance, offering limited insight into whether correct behavior reflects appropriate underlying mechanisms and risking confirmation bias. We introduce a simple,…

Computation and Language · Computer Science 2026-04-01 Zoë Prins , Samuele Punzo , Frank Wildenburg , Giovanni Cinà , Sandro Pezzelle

Understanding how Transformer-based Language Models (LMs) learn and recall information is a key goal of the deep learning community. Recent interpretability methods project weights and hidden states obtained from the forward pass to the…

Computation and Language · Computer Science 2024-02-21 Shahar Katz , Yonatan Belinkov , Mor Geva , Lior Wolf

We study feature learning in a compositional variant of kernel ridge regression in which the predictor is applied to a learnable linear transformation of the input. When the response depends on the input only through a low-dimensional…

Statistics Theory · Mathematics 2026-02-17 Yunlu Chen , Yang Li , Keli Liu , Feng Ruan