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Active learning (AL) accelerates scientific discovery by prioritizing the most informative experiments, but traditional machine learning (ML) models used in AL suffer from cold-start limitations and domain-specific feature engineering,…

Machine Learning · Computer Science 2025-12-05 Hongchen Wang , Rafael Espinosa Castañeda , Jay R. Werber , Yao Fehlis , Edward Kim , Jason Hattrick-Simpers

Deep learning (DL) has gained much attention and become increasingly popular in modern data science. Computer scientists led the way in developing deep learning techniques, so the ideas and perspectives can seem alien to statisticians.…

Machine Learning · Statistics 2021-02-05 G. Jogesh Babu , David Banks , Hyunsoon Cho , David Han , Hailin Sang , Shouyi Wang

Machine learning (ML) is transforming all areas of science. The complex and time-consuming calculations in molecular simulations are particularly suitable for a machine learning revolution and have already been profoundly impacted by the…

Chemical Physics · Physics 2019-11-11 Frank Noé , Alexandre Tkatchenko , Klaus-Robert Müller , Cecilia Clementi

Multi-Task Learning (MTL) aims at boosting the overall performance of each individual task by leveraging useful information contained in multiple related tasks. It has shown great success in natural language processing (NLP). Currently, a…

Computation and Language · Computer Science 2020-08-10 Jianquan Li , Xiaokang Liu , Wenpeng Yin , Min Yang , Liqun Ma , Yaohong Jin

Large Language Models (LLMs) are increasingly adopted in educational contexts to provide personalized support to students and teachers. The unprecedented capacity of LLM-based applications to understand and generate natural language can…

Computers and Society · Computer Science 2024-07-17 Jinsook Lee , Yann Hicke , Renzhe Yu , Christopher Brooks , René F. Kizilcec

Recent advancements in artificial intelligence (AI) are fundamentally reshaping computing, with large language models (LLMs) now effectively being able to generate and interpret source code and natural language instructions. These emergent…

The number of scientific articles produced every year is growing rapidly. Providing quality control over them is crucial for scientists and, ultimately, for the public good. In modern science, this process is largely delegated to peer…

Large language models (LLMs) are increasingly utilized by researchers across a wide range of domains, and qualitative social science is no exception; however, this adoption faces persistent challenges, including interpretive bias, low…

Computation and Language · Computer Science 2025-10-30 Ali Sanaei , Ali Rajabzadeh

Deep Learning has implemented a wide range of applications and has become increasingly popular in recent years. The goal of multimodal deep learning (MMDL) is to create models that can process and link information using various modalities.…

Machine Learning · Computer Science 2022-02-21 Jabeen Summaira , Xi Li , Amin Muhammad Shoib , Jabbar Abdul

Considerable progress has been made in the recent literature studies to tackle the Algorithms Selection and Parametrization (ASP) problem, which is diversified in multiple meta-learning setups. Yet there is a lack of surveys and comparative…

Machine Learning · Computer Science 2025-04-09 Moncef Garouani

In many economically relevant contexts where machine learning is deployed, multiple platforms obtain data from the same pool of users, each of whom selects the platform that best serves them. Prior work in this setting focuses exclusively…

Machine Learning · Computer Science 2026-03-02 Adhyyan Narang , Sarah Dean , Lillian J Ratliff , Maryam Fazel

Political science, and social science in general, have traditionally been using computational methods to study areas such as voting behavior, policy making, international conflict, and international development. More recently, increasingly…

Computation and Language · Computer Science 2020-05-15 Kakia Chatsiou , Slava Jankin Mikhaylov

Molecular Dynamics (MD) simulation is widely used to analyze the properties of molecules and materials. Most practical applications, such as comparison with experimental measurements, designing drug molecules, or optimizing materials, rely…

Chemical Physics · Physics 2018-12-20 Frank Noé

Learning from data has led to substantial advances in a multitude of disciplines, including text and multimedia search, speech recognition, and autonomous-vehicle navigation. Can machine learning enable similar leaps in the natural and…

Machine Learning · Computer Science 2022-11-22 Alice E. A. Allen , Alexandre Tkatchenko

Large Language Models(LLMs) have dramatically revolutionized the field of Natural Language Processing(NLP), offering remarkable capabilities that have garnered widespread usage. However, existing interaction paradigms between LLMs and users…

Computation and Language · Computer Science 2024-03-11 Juhao Liang , Ziwei Wang , Zhuoheng Ma , Jianquan Li , Zhiyi Zhang , Xiangbo Wu , Benyou Wang

Adult learning is increasingly recognized as a crucial way for personal development and societal progress. It however is challenging, and adult learners face unique challenges such as balancing education with other life responsibilities.…

Social and Information Networks · Computer Science 2024-04-23 Fang Liu , Bosheng Ding , Chong Guan , Zhang Wei , Dusit Niyato , Justina Tan

Providing personalized assistance at scale is a long-standing challenge for computing educators, but a new generation of tools powered by large language models (LLMs) offers immense promise. Such tools can, in theory, provide on-demand help…

Computers and Society · Computer Science 2024-01-09 Brad Sheese , Mark Liffiton , Jaromir Savelka , Paul Denny

Context: Machine Learning (ML) is integrated into a growing number of systems for various applications. Because the performance of an ML model is highly dependent on the quality of the data it has been trained on, there is a growing…

Machine Learning · Computer Science 2024-06-03 Pierre-Olivier Côté , Amin Nikanjam , Nafisa Ahmed , Dmytro Humeniuk , Foutse Khomh

This guide introduces Large Language Models (LLM) as a highly versatile text analysis method within the social sciences. As LLMs are easy-to-use, cheap, fast, and applicable on a broad range of text analysis tasks, ranging from text…

Computation and Language · Computer Science 2023-07-26 Petter Törnberg

Scientific publishing lays the foundation of science by disseminating research findings, fostering collaboration, encouraging reproducibility, and ensuring that scientific knowledge is accessible, verifiable, and built upon over time.…