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Machine learning (ML) methods are proliferating in scientific research. However, the adoption of these methods has been accompanied by failures of validity, reproducibility, and generalizability. These failures can hinder scientific…

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

The Functional Failure Rate analysis of today's complex circuits is a difficult task and requires a significant investment in terms of human efforts, processing resources and tool licenses. Thereby, de-rating or vulnerability factors are a…

Signal Processing · Electrical Eng. & Systems 2020-02-27 Thomas Lange , Aneesh Balakrishnan , Maximilien Glorieux , Dan Alexandrescu , Luca Sterpone

Machine learning (ML) algorithms are increasingly deployed to make critical decisions in socioeconomic applications such as finance, criminal justice, and autonomous driving. However, due to their data-driven and pattern-seeking nature, ML…

Software Engineering · Computer Science 2026-01-08 Verya Monjezi , Ashish Kumar , Ashutosh Trivedi , Gang Tan , Saeid Tizpaz-Niari

Machine learning (ML) is transforming modeling and control in the physical, engineering, and biological sciences. However, rapid development has outpaced the creation of standardized, objective benchmarks - leading to weak baselines,…

We use machine learning (ML) to infer stress and plastic flow rules using data from repre- sentative polycrystalline simulations. In particular, we use so-called deep (multilayer) neural networks (NN) to represent the two response…

Computational Physics · Physics 2018-09-05 Reese E. Jones , Jeremy A. Templeton , Clay M. Sanders , Jakob T. Ostien

The translation of high-level abstract features into clear, and testable functional requirements (FRs) is a crucial step in software development, bridging the gap between user needs and technical specifications. In engineering practice,…

Software Engineering · Computer Science 2025-05-20 Xiaoli Lian , Jiajun Wu , Xiaoyun Gao , Shuaisong Wang , Li Zhang

We introduce the Fourier Learning Machine (FLM), a neural network (NN) architecture designed to represent a multidimensional nonharmonic Fourier series. The FLM uses a simple feedforward structure with cosine activation functions to learn…

Machine Learning · Computer Science 2026-03-20 Mominul Rubel , Adam Meyers , Gabriel Nicolosi

Deep recommender systems (DRS) are critical for current commercial online service providers, which address the issue of information overload by recommending items that are tailored to the user's interests and preferences. They have…

Information Retrieval · Computer Science 2023-02-17 Bo Chen , Xiangyu Zhao , Yejing Wang , Wenqi Fan , Huifeng Guo , Ruiming Tang

For functional data lying on an unknown nonlinear low-dimensional space, we study manifold learning and introduce the notions of manifold mean, manifold modes of functional variation and of functional manifold components. These constitute…

Statistics Theory · Mathematics 2012-05-29 Dong Chen , Hans-Georg Müller

Machine learning (ML) needs industry-standard performance benchmarks to support design and competitive evaluation of the many emerging software and hardware solutions for ML. But ML training presents three unique benchmarking challenges…

Machine learning (ML) teams often work on a project just to realize the performance of the model is not good enough. Indeed, the success of ML-enabled systems involves aligning data with business problems, translating them into ML tasks,…

Software Engineering · Computer Science 2022-06-22 Hugo Villamizar , Marcos Kalinowski , Helio Lopes

Finite state machines (FSM) are executable formal specifications of reactive systems. These machines are designed based on systems' requirements. The requirements are often recorded in textual documents written in natural languages. FSMs…

Software Engineering · Computer Science 2026-04-01 Omer Nguena Timo , Paul-Alexis Rodriguez , Florent Avellaneda

Today, intelligent systems that offer artificial intelligence capabilities often rely on machine learning. Machine learning describes the capacity of systems to learn from problem-specific training data to automate the process of analytical…

Artificial Intelligence · Computer Science 2021-04-15 Christian Janiesch , Patrick Zschech , Kai Heinrich

As machine learning (ML) components become increasingly integrated into software systems, the emphasis on the ethical or responsible aspects of their use has grown significantly. This includes building ML-based systems that adhere to…

Software Engineering · Computer Science 2023-10-11 Hira Naveed

Machine learning can provide deep insights into data, allowing machines to make high-quality predictions and having been widely used in real-world applications, such as text mining, visual classification, and recommender systems. However,…

Machine Learning · Computer Science 2020-08-11 Meng Wang , Weijie Fu , Xiangnan He , Shijie Hao , Xindong Wu

Nonnegative Matrix Factorization (NMF) aims to factorize a matrix into two optimized nonnegative matrices and has been widely used for unsupervised learning tasks such as product recommendation based on a rating matrix. However, although…

Social and Information Networks · Computer Science 2015-04-03 Junyu Xuan , Jie Lu , Xiangfeng Luo , Guangquan Zhang

While machine learning (ML) models are increasingly used due to their high predictive power, their use in understanding the data-generating process (DGP) is limited. Understanding the DGP requires insights into feature-target associations,…

In the last few years, the Machine Learning (ML) and Artificial Intelligence community has developed an increasing interest in Software Engineering (SE) for ML Systems leading to a proliferation of best practices, rules, and guidelines…

Software Engineering · Computer Science 2023-06-27 Georgios Christos Chouliaras , Kornel Kiełczewski , Amit Beka , David Konopnicki , Lucas Bernardi

The widespread adoption of autonomous systems depends on providing guarantees of safety and functional correctness, at both design time and runtime. Information about the extent to which functional requirements can be met in combination…

Robotics · Computer Science 2016-07-25 Jeremy Morse , Dejanira Araiza-Illan , Jonathan Lawry , Arthur Richards , Kerstin Eder