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In Large Language Model (LLM) fine-tuning, parameter and data selection are common strategies for reducing fine-tuning cost, yet they are typically driven by separate scoring mechanisms. When a parameter mask and data subset jointly…

Machine Learning · Computer Science 2026-05-08 Xinrui Chen , Liu Yang , Ou Wu

Fine-tuning large language models (LLMs) on downstream tasks requires substantial computational resources. Selective PEFT, a class of parameter-efficient fine-tuning (PEFT) methodologies, aims to mitigate these computational challenges by…

Computation and Language · Computer Science 2025-06-24 Aradhye Agarwal , Suhas K Ramesh , Ayan Sengupta , Tanmoy Chakraborty

Large Language Models (LLMs) typically rely on Supervised Fine-Tuning (SFT) to specialize in downstream tasks, with the Cross Entropy (CE) loss being the de facto choice. However, CE maximizes the likelihood of observed data without…

Machine Learning · Computer Science 2025-04-08 Ziniu Li , Congliang Chen , Tian Xu , Zeyu Qin , Jiancong Xiao , Zhi-Quan Luo , Ruoyu Sun

Self-generated counterfactual explanations (SCEs) are minimally modified inputs (minimality) generated by large language models (LLMs) that flip their own predictions (validity), offering a causally grounded approach to unraveling black-box…

Computation and Language · Computer Science 2026-05-13 Yilong Wang , Qianli Wang , Bohao Chu , Yihong Liu , Jing Yang , Simon Ostermann

Molecular property prediction has gained significant attention due to its transformative potential in multiple scientific disciplines. Conventionally, a molecule graph can be represented either as a graph-structured data or a SMILES text.…

Machine Learning · Computer Science 2023-07-17 Chen Qian , Huayi Tang , Zhirui Yang , Hong Liang , Yong Liu

The ultimate goal of drug design is to find novel compounds with desirable pharmacological properties. Designing molecules retaining particular scaffolds as the core structures of the molecules is one of the efficient ways to obtain…

Quantitative Methods · Quantitative Biology 2019-09-06 Yibo Li , Jianxing Hu , Yanxing Wang , Jielong Zhou , Liangren Zhang , Zhenming Liu

The deployment of large language models (LLMs) is often constrained by their substantial computational and memory demands. While structured pruning presents a viable approach by eliminating entire network components, existing methods suffer…

Machine Learning · Computer Science 2025-05-07 Hanyu Hu , Xiaoming Yuan

Large language model personalization typically adapts outputs to user preferences and style but does not account for differences in user evaluation capacity across domains of expertise. This limitation can encourage Professional Domain…

Computation and Language · Computer Science 2026-05-18 Sen Yang , Yinglei Ma

In therapeutic design, balancing various physiochemical properties is crucial for molecule development, similar to how Multiparameter Optimization (MPO) evaluates multiple variables to meet a primary goal. While many molecular features can…

Biomolecules · Quantitative Biology 2024-01-03 Agustin Kruel , Andrew D. McNaughton , Neeraj Kumar

Large language models (LLMs) equipped with chain-of-thought (CoT) achieve strong performance and offer a window into LLM behavior. However, recent evidence suggests that improvements in CoT capabilities often come with redundant reasoning…

Computation and Language · Computer Science 2026-02-03 Yanrui Du , Sendong Zhao , Yibo Gao , Danyang Zhao , Qika Lin , Ming Ma , Jiayun Li , Yi Jiang , Kai He , Qianyi Xu , Bing Qin , Mengling Feng

Soft Prompt Tuning (SPT) is a parameter-efficient method for adapting pre-trained language models (PLMs) to specific tasks by inserting learnable embeddings, or soft prompts, at the input layer of the PLM, without modifying its parameters.…

Computation and Language · Computer Science 2024-02-07 Fred Philippy , Siwen Guo , Shohreh Haddadan , Cedric Lothritz , Jacques Klein , Tegawendé F. Bissyandé

While contrastive learning is proven to be an effective training strategy in computer vision, Natural Language Processing (NLP) is only recently adopting it as a self-supervised alternative to Masked Language Modeling (MLM) for improving…

Computation and Language · Computer Science 2021-09-16 Hooman Sedghamiz , Shivam Raval , Enrico Santus , Tuka Alhanai , Mohammad Ghassemi

Configuration optimization remains a critical bottleneck in machine learning, requiring coordinated tuning across model architecture, training strategy, feature engineering, and hyperparameters. Traditional approaches treat these dimensions…

Artificial Intelligence · Computer Science 2025-08-22 Yuxing Lu , Yucheng Hu , Nan Sun , Xukai Zhao

The last year has witnessed the rapid progress of large language models (LLMs) across diverse domains. Among them, CodeLLMs have garnered particular attention because they can not only assist in completing various programming tasks but also…

Artificial Intelligence · Computer Science 2024-10-25 Yibo Miao , Bofei Gao , Shanghaoran Quan , Junyang Lin , Daoguang Zan , Jiaheng Liu , Jian Yang , Tianyu Liu , Zhijie Deng

State-of-the-art Large Multi-Modal Models (LMMs) have demonstrated exceptional capabilities in vision-language tasks. Despite their advanced functionalities, the performances of LMMs are still limited in challenging scenarios that require…

Computer Vision and Pattern Recognition · Computer Science 2024-02-20 Xuanyu Lei , Zonghan Yang , Xinrui Chen , Peng Li , Yang Liu

Recently, the increasing demand for superior medical services has highlighted the discrepancies in the medical infrastructure. With big data, especially texts, forming the foundation of medical services, there is an exigent need for…

Computation and Language · Computer Science 2024-07-17 Yuanhe Tian , Ruyi Gan , Yan Song , Jiaxing Zhang , Yongdong Zhang

Large Language Models (LLMs) frequently lack domain-specific knowledge and even fine-tuned models tend to hallucinate. Hence, more reliable models that can include external knowledge are needed. We present a pipeline, 4StepFocus, and…

Computation and Language · Computer Science 2024-09-04 Derian Boer , Fabian Koch , Stefan Kramer

Resource-efficient training optimization techniques are becoming increasingly important as the size of large language models (LLMs) continues to grow. In particular, batch packing is commonly used in pre-training and supervised fine-tuning…

Computation and Language · Computer Science 2026-03-02 Jaekyung Cho

Large language models (LLMs) are commonly adapted to downstream tasks through fine-tuning, but fine-tuning data often contains sensitive information that may be leaked by the resulting model. Differential privacy (DP) offers formal…

Machine Learning · Computer Science 2026-05-19 Haichao Sha , Zihao Wang , Yuncheng Wu , Hong Chen , Wei Dong

Large language models (LLMs) have revolutionized natural language processing (NLP) by excelling at understanding and generating human-like text. However, their widespread deployment can be prohibitively expensive. SortedNet is a recent…

Computation and Language · Computer Science 2024-02-12 Parsa Kavehzadeh , Mojtaba Valipour , Marzieh Tahaei , Ali Ghodsi , Boxing Chen , Mehdi Rezagholizadeh
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