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With adversarial or otherwise normal prompts, existing large language models (LLM) can be pushed to generate toxic discourses. One way to reduce the risk of LLMs generating undesired discourses is to alter the training of the LLM. This can…

Computation and Language · Computer Science 2023-02-28 Meng Cao , Mehdi Fatemi , Jackie Chi Kit Cheung , Samira Shabanian

Large Language Models(LLMs) are increasingly explored for cybersecurity applications such as vulnerability detection. In the domain of threat modelling, prior work has primarily evaluated a number of general-purpose Large Language Models…

Cryptography and Security · Computer Science 2026-05-12 Saba Pourhanifeh , AbdulAziz AbdulGhaffar , Ashraf Matrawy

Probabilistic linear discriminant analysis (PLDA) is a method used for biometric problems like speaker or face recognition that models the variability of the samples using two latent variables, one that depends on the class of the sample…

Machine Learning · Computer Science 2019-11-27 Luciana Ferrer , Mitchell McLaren

Identification of protein-protein interactions (PPIs) helps derive cellular mechanistic understanding, particularly in the context of complex conditions such as neurodegenerative disorders, metabolic syndromes, and cancer. Large Language…

Machine Learning · Computer Science 2025-08-18 Sanket Jantre , Tianle Wang , Gilchan Park , Kriti Chopra , Nicholas Jeon , Xiaoning Qian , Nathan M. Urban , Byung-Jun Yoon

Supervised fine-tuning (SFT) is a standard approach for adapting large language models to specialized domains, yet its application to protein sequence modeling and protein language models (PLMs) remains ad hoc. This is in part because…

Machine Learning · Computer Science 2025-12-11 Amin Tavakoli , Raswanth Murugan , Ozan Gokdemir , Arvind Ramanathan , Frances Arnold , Anima Anandkumar

Proteins adopt multiple structural conformations to perform their diverse biological functions, and understanding these conformations is crucial for advancing drug discovery. Traditional physics-based simulation methods often struggle with…

Biomolecules · Quantitative Biology 2025-03-14 Jiarui Lu , Xiaoyin Chen , Stephen Zhewen Lu , Chence Shi , Hongyu Guo , Yoshua Bengio , Jian Tang

We show that for unconstrained Deep Linear Discriminant Analysis (LDA) classifiers, maximum-likelihood training admits pathological solutions in which class means drift together, covariances collapse, and the learned representation becomes…

Machine Learning · Statistics 2026-01-06 Maxat Tezekbayev , Rustem Takhanov , Arman Bolatov , Zhenisbek Assylbekov

This paper addresses the critical challenge of deriving interpretable confidence scores from generative language models (LLMs) when applied to multi-label content safety classification. While models like LLaMA Guard are effective for…

Computation and Language · Computer Science 2025-12-01 Anjaneya Praharaj , Jaykumar Kasundra

Many safety post-training methods for large language models (LLMs) are designed to modify the model's behaviour from producing unsafe answers to issuing refusals. However, such distribution shifts are often brittle and degrade performance…

Computation and Language · Computer Science 2025-10-08 David Dobre , Mehrnaz Mofakhami , Sophie Xhonneux , Leo Schwinn , Gauthier Gidel

The prediction of intrinsic disorder regions has significant implications for understanding protein functions and dynamics. It can help to discover novel protein-protein interactions essential for designing new drugs and enzymes. Recently,…

Machine Learning · Computer Science 2025-08-19 Krzysztof Kotowski , Irena Roterman , Katarzyna Stapor

As one of the most powerful topic models, Latent Dirichlet Allocation (LDA) has been used in a vast range of tasks, including document understanding, information retrieval and peer-reviewer assignment. Despite its tremendous popularity, the…

Machine Learning · Computer Science 2021-04-13 Qi Zhou , Haipeng Chen , Yitao Zheng , Zhen Wang

Large Language models (LLMs) have emerged as powerful tools for addressing challenges across diverse domains. Notably, recent studies have demonstrated that large language models significantly enhance the efficiency of biomolecular analysis…

Computation and Language · Computer Science 2025-03-07 Jiyue Jiang , Zikang Wang , Yuheng Shan , Heyan Chai , Jiayi Li , Zixian Ma , Xinrui Zhang , Yu Li

Deploying machine learning (ML) models in the wild is challenging as it suffers from distribution shifts, where the model trained on an original domain cannot generalize well to unforeseen diverse transfer domains. To address this…

Cryptography and Security · Computer Science 2023-08-17 Tianshuo Cong , Xinlei He , Yun Shen , Yang Zhang

Large Language Models (LLM) have made remarkable progress, but concerns about potential biases and harmful content persist. To address these apprehensions, we introduce a practical solution for ensuring LLM's safe and ethical use. Our novel…

Cryptography and Security · Computer Science 2025-04-24 Chaima Njeh , Haïfa Nakouri , Fehmi Jaafar

Large Language Models (LLMs) are increasingly used in intelligent systems that perform reasoning, summarization, and code generation. Their ability to follow natural-language instructions, while powerful, also makes them vulnerable to a new…

Cryptography and Security · Computer Science 2025-11-13 Daniyal Ganiuly , Assel Smaiyl

The increasing use of large language models (LLMs) trained by third parties raises significant security concerns. In particular, malicious actors can introduce backdoors through poisoning attacks to generate undesirable outputs. While such…

Cryptography and Security · Computer Science 2024-07-19 Shuli Jiang , Swanand Ravindra Kadhe , Yi Zhou , Farhan Ahmed , Ling Cai , Nathalie Baracaldo

Large language models (LLMs) offer unprecedented and growing capabilities, but also introduce complex safety and security challenges that resist conventional risk management. While conventional probabilistic risk analysis (PRA) requires…

Cryptography and Security · Computer Science 2025-05-26 Alexander Gutfraind , Vicki Bier

Reparameterized diffusion models (RDMs) have recently matched autoregressive methods in protein generation, motivating their use for challenging tasks such as designing membrane proteins, which possess interleaved soluble and transmembrane…

Biomolecules · Quantitative Biology 2025-09-30 Shrey Goel , Peregrine M. Schray , Yinuo Zhang , Sophia Vincoff , Huong T. Kratochvil , Pranam Chatterjee

Ensuring safe and contextually appropriate behaviour in Large Language Models (LLMs) remains a critical challenge for real-world deployment. We present \textbf{SafeCtrl-RL}, an inference-time behavioural control framework that enables…

Computation and Language · Computer Science 2026-05-26 Michael Orme , Yanchao Yu , Zhiyuan Tan

We introduce aligned probing, a novel interpretability framework that aligns the behavior of language models (LMs), based on their outputs, and their internal representations (internals). Using this framework, we examine over 20 OLMo,…

Computation and Language · Computer Science 2025-09-25 Andreas Waldis , Vagrant Gautam , Anne Lauscher , Dietrich Klakow , Iryna Gurevych