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Related papers: Generative AI for Enzyme Design and Biocatalysis

200 papers

Designing safe and sustainable chemicals is critical to combat chemical pollution in our environment. Machine learning (ML) methods have been developed to aid with de novo molecule design. However, data on the environmental impacts of…

Human-Computer Interaction · Computer Science 2026-05-18 Coelina Robinson , Franziska Weissbach , Kjell Jorner , Mennatallah El-Assady , Christina Humer

Biomolecular interactions underpin almost all biological processes, and their rational design is central to programming new biological functions. Generative AI models have emerged as powerful tools for molecular design, yet most remain…

Transitioning from Education 1.0 to Education 5.0, the integration of generative artificial intelligence (GenAI) revolutionizes the learning environment by fostering enhanced human-machine collaboration, enabling personalized, adaptive and…

Computers and Society · Computer Science 2024-12-13 Sanjay Chakraborty

The recent surge in generative AI technologies, such as large language models and diffusion models, has boosted the development of AI applications in various domains, including science, finance, and education. Concurrently, adaptive…

Computers and Society · Computer Science 2024-07-02 Hang Li , Tianlong Xu , Chaoli Zhang , Eason Chen , Jing Liang , Xing Fan , Haoyang Li , Jiliang Tang , Qingsong Wen

Generative AI enables automated, effective manipulation at scale. Despite the growing general ethical discussion around generative AI, the specific manipulation risks remain inadequately investigated. This article outlines essential…

Computers and Society · Computer Science 2025-03-10 Michael Klenk

Generative artificial intelligence (GenAI) is transforming education, redefining the role of trainers and coaches in learning environments. In our study, we explore how AI integrates into the design process of learning materials, assessing…

Computers and Society · Computer Science 2026-03-31 Alexander Komar , Marc-André Heidelmann , Kristina Schaaff

Generative models emerge as promising candidates for novel sequence-data driven approaches to protein design, and for the extraction of structural and functional information about proteins deeply hidden in rapidly growing sequence…

Biomolecules · Quantitative Biology 2021-11-10 Jeanne Trinquier , Guido Uguzzoni , Andrea Pagnani , Francesco Zamponi , Martin Weigt

The emergence of Generative Artificial Intelligence (AI) and Large Language Models (LLMs) has marked a new era of Natural Language Processing (NLP), introducing unprecedented capabilities that are revolutionizing various domains. This paper…

Computation and Language · Computer Science 2024-08-26 Desta Haileselassie Hagos , Rick Battle , Danda B. Rawat

Generative AI models have revolutionized various fields by enabling the creation of realistic and diverse data samples. Among these models, diffusion models have emerged as a powerful approach for generating high-quality images, text, and…

Computer Vision and Pattern Recognition · Computer Science 2024-02-27 Gaurav Raut , Apoorv Singh

Generative AI (GenAI) is changing the nature of knowledge work, particularly for Product Managers (PMs) in software development teams. While much software engineering research has focused on developers' interactions with GenAI, there is…

Software Engineering · Computer Science 2025-10-06 Mara Ulloa , Jenna L. Butler , Sankeerti Haniyur , Courtney Miller , Barrett Amos , Advait Sarkar , Margaret-Anne Storey

Generative AI is a class of machine learning technology that learns to generate new data from training data. While deep fakes and media-and art-related generative AI breakthroughs have recently caught people's attention and imagination, the…

Computers and Society · Computer Science 2020-03-18 Stephanie Houde , Vera Liao , Jacquelyn Martino , Michael Muller , David Piorkowski , John Richards , Justin Weisz , Yunfeng Zhang

This paper examines the impact of Generative Artificial Intelligence (GenAI) on scientific practices, conducting a qualitative review of selected literature to explore its applications, benefits, and challenges. The review draws on the…

Computers and Society · Computer Science 2025-07-14 Ryan Harries , Cornelia Lawson , Philip Shapira

The 21st century is presenting humankind with unprecedented environmental and medical challenges. The ability to design novel proteins tailored for specific purposes could transform our ability to respond timely to these issues. Recent…

Biomolecules · Quantitative Biology 2022-08-24 Noelia Ferruz , Birte Höcker

Large Language Models (LLMs) have revolutionized AI systems by enabling communication with machines using natural language. Recent developments in Generative AI (GenAI) like Vision-Language Models (GPT-4V) and Gemini have shown great…

Computation and Language · Computer Science 2024-07-17 Jakub M. Tomczak

Generative AI has recently had a profound impact on various fields, including daily life, research, and education. To explore its efficient utilization in data-driven materials science, we organized a hackathon -- AIMHack2024 -- in July…

Computers and Society · Computer Science 2025-09-29 Takahiro Misawa , Ai Koizumi , Ryo Tamura , Kazuyoshi Yoshimi

This paper provides a comprehensive analysis of Generative AI (GenAI) potential to revolutionise software coding through increased efficiency and reduced time span for writing code. It acknowledges the transformative power of GenAI in…

Software Engineering · Computer Science 2024-11-01 Marcellin Atemkeng , Sisipho Hamlomo , Brian Welman , Nicole Oyetunji , Pouya Ataei , Jean Louis K. E Fendji

The aim of this paper is to review the use of GenAI in scientometrics, and to begin a debate on the broader implications for the field. First, we provide an introduction on GenAI's generative and probabilistic nature as rooted in…

Computation and Language · Computer Science 2025-07-02 Benedetto Lepori , Jens Peter Andersen , Karsten Donnay

User simulation is an emerging interdisciplinary topic with multiple critical applications in the era of Generative AI. It involves creating an intelligent agent that mimics the actions of a human user interacting with an AI system,…

Artificial Intelligence · Computer Science 2026-04-22 Krisztian Balog , ChengXiang Zhai

Complex data analysis inherently seeks unexpected insights through exploratory visual analysis methods, transcending logical, step-by-step processing. However, existing interfaces such as notebooks and dashboards have limitations in…

Human-Computer Interaction · Computer Science 2024-03-22 Zijian Ding , Joel Chan

Design is a non-linear, reflective process in which practitioners engage with visual, semantic, and other expressive materials to explore, iterate, and refine ideas. As Generative AI (GenAI) becomes integrated into professional design…

Human-Computer Interaction · Computer Science 2026-03-04 Xiaohan Peng , Wendy E. Mackay , Janin Koch