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Protein Language Models (PLMs), pre-trained on extensive evolutionary data from natural proteins, have emerged as indispensable tools for protein design. While powerful, PLMs often struggle to produce proteins with precisely specified…

Biomolecules · Quantitative Biology 2025-09-15 Long-Kai Huang , Rongyi Zhu , Bing He , Jianhua Yao

Large language models (LLMs) are able to generate grammatically well-formed text, but how do they encode their syntactic knowledge internally? While prior work has focused largely on binary grammatical contrasts, in this work, we study the…

Computation and Language · Computer Science 2025-09-16 Alina Klerings , Jannik Brinkmann , Daniel Ruffinelli , Simone Ponzetto

Multimodal Large Language Models (MLLMs) often exhibit significant modality preference, which is a tendency to favor one modality over another. Depending on the input, they may over-rely on linguistic priors relative to visual evidence, or…

Machine Learning · Computer Science 2026-02-16 Zihan Huang , Xintong Li , Rohan Surana , Tong Yu , Rui Wang , Julian McAuley , Jingbo Shang , Junda Wu

The rise of large language models (LLMs) has prompted increasing interest in their use as in-context learning agents. At the core of agentic behavior is the capacity for exploration, or the ability to actively gather information about the…

Computation and Language · Computer Science 2024-10-14 Nate Rahn , Pierluca D'Oro , Marc G. Bellemare

To deliver high-quality, personalized responses, large language models (LLMs) must effectively incorporate context -- personal, demographic, and cultural information specific to an end-user. For example, asking the model to explain Newton's…

Computation and Language · Computer Science 2025-02-07 Jerry Zhi-Yang He , Sashrika Pandey , Mariah L. Schrum , Anca Dragan

Recent advances in large language models (LLMs) have led to the development of thinking language models that generate extensive internal reasoning chains before producing responses. While these models achieve improved performance,…

Machine Learning · Computer Science 2025-10-23 Constantin Venhoff , Iván Arcuschin , Philip Torr , Arthur Conmy , Neel Nanda

Role-playing has emerged as an effective technique for enhancing the reasoning capabilities of large language models (LLMs). However, existing methods primarily rely on prompt engineering, which often lacks stability and interpretability.…

Computation and Language · Computer Science 2025-09-30 Anyi Wang , Dong Shu , Yifan Wang , Yunpu Ma , Mengnan Du

Latent steering exploits internal representations of Large Language Models (LLMs) to guide generation, yet interventions on dense states can entangle distinct semantic features. In this paper, we investigate attention query activations as a…

Machine Learning · Computer Science 2026-05-25 Sumanta Bhattacharyya , Pedram Rooshenas

Post-training adaptation of language models is commonly achieved through parameter updates or input-based methods such as fine-tuning, parameter-efficient adaptation, and prompting. In parallel, a growing body of work modifies internal…

Computation and Language · Computer Science 2026-04-16 Simon Ostermann , Daniil Gurgurov , Tanja Baeumel , Michael A. Hedderich , Sebastian Lapuschkin , Wojciech Samek , Vera Schmitt

Large language models frequently produce errors in reasoning tasks despite possessing the underlying knowledge required for correct reasoning. One possible approach to improve reasoning consistency is through activation steering. However,…

Machine Learning · Computer Science 2026-05-22 Ian Li , Kapilesh Guruprasad , Raunak Sengupta , Ninad Satish , Loris D'Antoni , Rose Yu

Recent advances in automated theorem proving use Large Language Models (LLMs) to translate informal mathematical statements into formal proofs. However, informal cues are often ambiguous or lack strict logical structure, making it hard for…

Machine Learning · Computer Science 2025-10-14 Shashank Kirtania , Arun Iyer

This research explores strategies for steering the output of large language models (LLMs) towards specific styles, such as sentiment, emotion, or writing style, by adding style vectors to the activations of hidden layers during text…

Computation and Language · Computer Science 2024-02-05 Kai Konen , Sophie Jentzsch , Diaoulé Diallo , Peer Schütt , Oliver Bensch , Roxanne El Baff , Dominik Opitz , Tobias Hecking

While mechanistic interpretability tools like Sparse Autoencoders (SAEs) can uncover meaningful features within Large Language Models (LLMs), a critical gap remains in transforming these insights into practical actions for model…

Artificial Intelligence · Computer Science 2026-04-29 Ling Shi , Xinwei Wu , Xiaohu Zhao , Hao Wang , Heng Liu , Yangyang Liu , Linlong Xu , Longyue Wang , Deyi Xiong , Weihua Luo

Inference-time steering methods offer a lightweight alternative to fine-tuning large language models (LLMs) and vision-language models (VLMs) by modifying internal activations at test time without updating model weights. However, most…

Computation and Language · Computer Science 2025-07-25 Duy Nguyen , Archiki Prasad , Elias Stengel-Eskin , Mohit Bansal

Masked diffusion language models (MDLMs) generate text via iterative masked-token denoising, enabling mask-parallel decoding and distinct controllability and efficiency tradeoffs from autoregressive LLMs. Yet, efficient representation-level…

Computation and Language · Computer Science 2026-03-31 Adi Shnaidman , Erin Feiglin , Osher Yaari , Efrat Mentel , Amit Levi , Raz Lapid

Large Language Models (LLMs) trained for average correctness often exhibit mode collapse, producing narrow decision behaviors on tasks where multiple responses may be reasonable. This limitation is particularly problematic in ordinal…

Artificial Intelligence · Computer Science 2026-02-04 Eric Yang , Jong Ha Lee , Jonathan Amar , Elissa Ye , Yugang Jia

Controlling specific behaviors in large language models while preserving their general capabilities is a central challenge for safe and reliable artificial intelligence deployment. Current steering methods, such as vector addition and…

Machine Learning · Computer Science 2025-10-31 Hieu M. Vu , Tan M. Nguyen

Modern large language models (LLMs) are typically secured by auditing data, prompts, and refusal policies, while treating the forward pass as an implementation detail. We show that intermediate activations in decoder-only LLMs form a…

Cryptography and Security · Computer Science 2025-11-24 Zhiyuan Xu , Stanislav Abaimov , Joseph Gardiner , Sana Belguith

Large Language Models (LLMs) have demonstrated impressive capabilities in reasoning tasks, yet their reliance on static prompt structures and limited adaptability to complex scenarios remains a significant challenge. In this paper, we…

Artificial Intelligence · Computer Science 2025-07-09 Chengkun Cai , Xu Zhao , Haoliang Liu , Zhongyu Jiang , Tianfang Zhang , Zongkai Wu , Jenq-Neng Hwang , Lei Li

Autonomous Driving (AD) encounters significant safety hurdles in long-tail unforeseen driving scenarios, largely stemming from the non-interpretability and poor generalization of the deep neural networks within the AD system, particularly…

Artificial Intelligence · Computer Science 2024-03-25 Yixuan Wang , Ruochen Jiao , Sinong Simon Zhan , Chengtian Lang , Chao Huang , Zhaoran Wang , Zhuoran Yang , Qi Zhu
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