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Accurate structural relaxation is critical for advanced materials design. Traditional approaches built on physics-derived first-principles calculations are computationally expensive, motivating the creation of machine-learning interatomic…

Machine learning (ML) has emerged as a powerful tool for tackling complex regression and classification tasks, yet its success often hinges on the quality of training data. This study introduces an ML paradigm inspired by domain knowledge…

机器学习 · 计算机科学 2025-01-10 Mohsen Rashki

Automated AI classifiers should be able to defer the prediction to a human decision maker to ensure more accurate predictions. In this work, we jointly train a classifier with a rejector, which decides on each data point whether the…

机器学习 · 计算机科学 2023-04-12 Hussein Mozannar , Hunter Lang , Dennis Wei , Prasanna Sattigeri , Subhro Das , David Sontag

Training large language models (LLMs) efficiently while preserving model quality poses significant challenges, particularly with subbyte precision supported by state-of-the-art GPUs. Current mixed-precision training approaches either apply…

机器学习 · 计算机科学 2026-02-03 Yunjie Pan , Yongyi Yang , Hanmei Yang , Scott Mahlke

Missing data represents a fundamental challenge in machine learning applications, often reducing model performance and reliability. This problem is particularly acute in fields like bioinformatics and clinical machine learning, where…

机器学习 · 计算机科学 2025-09-04 Fatemeh Azad , Zoran Bosnić , Matjaž Kukar

The growing demands of the worldwide IT infrastructure stress the need for reduced power consumption, which is addressed in so-called transprecision computing by improving energy efficiency at the expense of precision. For example, reducing…

分布式、并行与集群计算 · 计算机科学 2020-07-30 Andrea Borghesi , Giuseppe Tagliavini , Michele Lombardi , Luca Benini , Michela Milano

A mathematical programming model for a class of single machine family scheduling problem is described in this technical report, with the aim of comparing the performance in solving the scheduling problem by means of mathematical programming…

最优化与控制 · 数学 2015-03-03 Davide Giglio

The Multimodal Large Language Models (MLLMs) have activated the capabilitiesof Large Language Models (LLMs) in solving visual-language tasks by integratingvisual information. The prevailing approach in existing MLLMs involvesemploying an…

计算机视觉与模式识别 · 计算机科学 2024-10-31 Tianxiang Wu , Minxin Nie , Ziqiang Cao

The interpretability of machine learning, particularly for deep neural networks, is crucial for decision making in real-world applications. One approach is replacing the un-interpretable machine learning model with a surrogate model, which…

机器学习 · 统计学 2020-07-22 Keiichi Kisamori , Keisuke Yamazaki , Yuto Komori , Hiroshi Tokieda

Designing faster algorithms for solving Mixed-Integer Linear Programming (MILP) problems is highly desired across numerous practical domains, as a vast array of complex real-world challenges can be effectively modeled as MILP formulations.…

人工智能 · 计算机科学 2026-01-23 Ruizhi Liu , Liming Xu , Xulin Huang , Jingyan Sui , Shizhe Ding , Boyang Xia , Chungong Yu , Dongbo Bu

Physics-Informed Machine Learning (PIML) offers a powerful paradigm of integrating data with physical laws to address important scientific problems, such as parameter estimation, inferring hidden physics, equation discovery, and state…

计算工程、金融与科学 · 计算机科学 2025-10-31 Letian Yi , Siyuan Yang , Ying Cui , Zhilu Lai

In this paper we provide a computation algorithm to get a global solution for the maximum rank correlation estimator using the mixed integer programming (MIP) approach. We construct a new constrained optimization problem by transforming all…

计量经济学 · 经济学 2022-08-11 Youngki Shin , Zvezdomir Todorov

Representation learning is fundamental to NLP, but building embeddings that work well at different computational budgets is challenging. Matryoshka Representation Learning (MRL) offers a flexible inference paradigm through nested…

计算与语言 · 计算机科学 2026-04-28 Phung Gia Huy , Hai An Vu , Minh-Phuc Truong , Thang Duc Tran , Linh Ngo Van , Thanh Hong Nguyen , Trung Le

Improving the generalization ability of Vision-Language Pre-trained Models (VLMs) under test-time data distribution shifts remains a critical challenge. The existing Test-Time Adaptation (TTA) methods fall short in fully leveraging the…

计算机视觉与模式识别 · 计算机科学 2025-06-05 Jiaming Yi , Ruirui Pan , Jishen Yang , Xiulong Yang

Mixed-Integer Programming (MIP), particularly Mixed-Integer Linear Programming (MILP) and Mixed-Integer Quadratic Programming (MIQP), has found extensive applications in domains such as portfolio optimization and network flow control, which…

最优化与控制 · 数学 2026-02-03 Zayn Wang

A novel two-phase molecule inference framework, mol-infer, has recently been developed to infer chemical graphs with prescribed abstract structures and desired property values through mixed integer linear programming (MILP) under the…

定量方法 · 定量生物学 2026-05-29 Jianshen Zhu , Raveena Rai , Taiyo Sohkawa , Naveed Ahmed Azam , Kazuya Haraguchi , Liang Zhao , Tatsuya Akutsu

Despite its significant promise and continuous technical advances, real-world applications of artificial intelligence (AI) remain limited. We attribute this to the "domain expert-AI-conundrum": while domain experts, such as clinician…

人机交互 · 计算机科学 2024-11-26 Evgeny Saveliev , Tim Schubert , Thomas Pouplin , Vasilis Kosmoliaptsis , Mihaela van der Schaar

Indefinite quadratic programs (QPs) are known to be very difficult to be solved to global optimality, so are linear programs with linear complementarity constraints. Treating the former as a subclass of the latter, this paper presents a…

最优化与控制 · 数学 2025-03-18 Xinyao Zhang , Shaoning Han , Jong-Shi Pang

Large language models (LLMs) effectively generate fluent text when the target output follows natural language patterns. However, structured prediction tasks confine the output format to a limited ontology, causing even very large models to…

计算与语言 · 计算机科学 2023-10-19 Derek Chen , Celine Lee , Yunan Lu , Domenic Rosati , Zhou Yu

Operations is a key challenge in the domain of machine learning pipeline deployments involving monitoring and management of real-time prediction quality. Typically, metrics like accuracy, RMSE etc., are used to track the performance of…