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Retrosynthesis is the cornerstone of organic chemistry, providing chemists in material and drug manufacturing access to poorly available and brand-new molecules. Conventional rule-based or expert-based computer-aided synthesis has obvious…

Machine Learning · Computer Science 2023-01-18 Zipeng Zhong , Jie Song , Zunlei Feng , Tiantao Liu , Lingxiang Jia , Shaolun Yao , Tingjun Hou , Mingli Song

Artificial intelligence is gaining strength and materials science can both contribute to and profit from it. In a simultaneous progress race, new materials, systems and processes can be devised and optimized thanks to machine learning…

Materials Science · Physics 2022-09-29 Cefe López

Artificial Intelligence (AI) is used to create more sustainable production methods and model climate change, making it a valuable tool in the fight against environmental degradation. This paper describes the paradox of an energy-consuming…

Artificial Intelligence · Computer Science 2026-03-17 Arnault Pachot , Céline Patissier

Organizations increasingly need to reassess their supply chain strategies in the rapidly modernizing world towards sustainability. This is particularly true in the United States, where supply chains are very extensive and consume a large…

Computers and Society · Computer Science 2025-01-22 MD Rokibul Hasan

It is important to develop sustainable processes in materials science and manufacturing that are environmentally friendly. AI can play a significant role in decision support here as evident from our earlier research leading to tools…

Artificial Intelligence · Computer Science 2023-03-27 Aparna S. Varde , Jianyu Liang

In recent years, recycling and disposal of end-of-life (EOL) electronic products has attracted considerable attention in response to concerns over resource recovery and environmental impacts of electronic waste (e-waste). In many countries,…

The AI industry is exploding in popularity, with increasing attention to potential harms and unwanted consequences. In the current digital ecosystem, AI deployments are often the product of AI supply chains (AISC): networks of outsourced…

Computers and Society · Computer Science 2025-07-04 Aspen K. Hopkins , Isabella Struckman , Kevin Klyman , Susan S. Silbey

Manufacturers have long benefited from reusing returned products and parts. This benevolent approach can minimize cost and help the manufacturer to play a role in sustaining the environment, something which is of utmost importance these…

Machine Learning · Computer Science 2022-01-21 Abbas Raza Ali , Pitipong J. Lin

Artificial intelligence (AI) is reshaping inverse design in manufacturing, enabling high-performance discovery in materials, products, and processes. However, purely data-driven approaches often struggle in realistic manufacturing settings…

Artificial Intelligence · Computer Science 2025-08-26 Hugon Lee , Hyeonbin Moon , Junhyeong Lee , Seunghwa RYu

The human ability to repurpose objects and processes is universal, but it is not a well-understood aspect of human intelligence. Repurposing arises in everyday situations such as finding substitutes for missing ingredients when cooking, or…

Artificial Intelligence · Computer Science 2021-09-20 Antonis Bikakis , Luke Dickens , Anthony Hunter , Rob Miller

The reverse engineering of a complex mixture, regardless of its nature, has become significant today. Being able to quickly assess the potential toxicity of new commercial products in relation to the environment presents a genuine…

Artificial Intelligence · Computer Science 2023-11-01 Pedro Marote , Marie Martin , Anne Bonhomme , Pierre Lantéri , Yohann Clément

Reverse engineering has been a standard practice in the hardware community for some time. It has only been within the last ten years that reverse engineering, or "program comprehension", has grown into the current sub-discipline of software…

Software Engineering · Computer Science 2007-05-23 Michael L. Nelson

With unorganized, unplanned and improper use of limited raw materials, an abundant amount of waste is being produced, which is harmful to our environment and ecosystem. While traditional linear production lines fail to address far-reaching…

Computers and Society · Computer Science 2022-05-03 Abdulla All noman , Umma Habiba Akter , Tahmid Hasan Pranto , AKM Bahalul Haque

Digital technologies have changed the way supply chain operations are structured. In this article, we conduct systematic syntheses of literature on the impact of new technologies on supply chains and the related cyber risks. A…

Computers and Society · Computer Science 2020-05-18 Petar Radanliev , David De Roure , Kevin Page , Jason Nurse , Rafael Mantilla Montalvo , Omar Santos , La Treall Maddox , Peter Burnap

Remanufacturing is fundamentally more challenging than traditional manufacturing due to the significant uncertainty, variability, and incompleteness inherent in end-of-life (EoL) products. At the same time, it has become increasingly…

Systems and Control · Electrical Eng. & Systems 2026-04-06 Sibo Tian , Xiao Liang , Sara Behdad , Minghui Zheng

Every year, millions of pounds of medicines remain unused in the U.S. and are subject to an in-home disposal, i.e., kept in medicine cabinets, flushed in toilet or thrown in regular trash. In-home disposal, however, can negatively impact…

Computer Vision and Pattern Recognition · Computer Science 2020-07-29 Bahram Marami , Atabak Reza Royaee

Materials design is an important component of modern science and technology, yet traditional approaches rely heavily on trial-and-error and can be inefficient. Computational techniques, enhanced by modern artificial intelligence (AI), have…

We present novel mathematical models for inventory management within a reverse logistics system. Technological advancements, sustainability initiatives, and evolving customer behaviours have significantly increased the demand for repaired…

Optimization and Control · Mathematics 2024-06-21 I. B. Wadhawan , M. M. Rizvi

The discovery of advanced materials is the cornerstone of human technological development and progress. The structures of materials and their corresponding properties are essentially the result of a complex interplay of multiple degrees of…

Materials Science · Physics 2025-02-21 Xiao-Qi Han , Xin-De Wang , Meng-Yuan Xu , Zhen Feng , Bo-Wen Yao , Peng-Jie Guo , Ze-Feng Gao , Zhong-Yi Lu

Designing novel materials that possess desired properties is a central need across many manufacturing industries. Driven by that industrial need, a variety of algorithms and tools have been developed that combine AI (machine learning and…

Computational Engineering, Finance, and Science · Computer Science 2020-01-27 Seiji Takeda , Toshiyuki Hama , Hsiang-Han Hsu , Toshiyuki Yamane , Koji Masuda , Victoria A. Piunova , Dmitry Zubarev , Jed Pitera , Daniel P. Sanders , Daiju Nakano
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