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In recent years, machine learning (ML) has gained significant popularity in the field of chemical informatics and electronic structure theory. These techniques often require researchers to engineer abstract "features" that encode chemical…

Human-Computer Interaction · Computer Science 2022-07-11 Xiangyun Lei , Fred Hohman , Duen Horng Chau , Andrew J. Medford

The past few years have witnessed vibrant efforts in discovering new two-dimensional (2D) semiconductor materials from both academia and the industry, due to their promising potential in resolving the severe performance deterioration of…

Human-Computer Interaction · Computer Science 2026-05-07 Kavinda Athapaththu , Shiwei Chen , Yuan Fang , Sanchali Mitra , Yee Sin Ang , Yong Wang

The design of alloys is a multi-scale problem that requires a holistic approach that involves retrieving relevant knowledge, applying advanced computational methods, conducting experimental validations, and analyzing the results, a process…

Artificial Intelligence · Computer Science 2024-07-16 Alireza Ghafarollahi , Markus J. Buehler

Modern automobiles have evolved from just being mechanical machines to having full-fledged electronics systems that enhance vehicle dynamics and driver experience. However, these complex hardware and software systems, if not properly…

Human-Computer Interaction · Computer Science 2020-11-25 Arpit Narechania , Ahsan Qamar , Alex Endert

With the rapid development of online education in recent years, there has been an increasing number of learning platforms that provide students with multi-step questions to cultivate their problem-solving skills. To guarantee the high…

Human-Computer Interaction · Computer Science 2020-09-29 Meng Xia , Reshika Palaniyappan Velumani , Yong Wang , Huamin Qu , Xiaojuan Ma

Designing synthetic routes for novel molecules is pivotal in various fields like medicine and chemistry. In this process, researchers need to explore a set of synthetic reactions to transform starting molecules into intermediates step by…

Human-Computer Interaction · Computer Science 2025-03-18 Qipeng Wang , Rui Sheng , Shaolun Ruan , Xiaofu Jin , Chuhan Shi , Min Zhu

Deep optics has emerged as a promising approach by co-designing optical elements with deep learning algorithms. However, current research typically overlooks the analysis and optimization of manufacturing and assembly tolerances. This…

Computer Vision and Pattern Recognition · Computer Science 2025-02-10 Jun Dai , Liqun Chen , Xinge Yang , Yuyao Hu , Jinwei Gu , Tianfan Xue

Multimodal sentiment analysis aims to recognize people's attitudes from multiple communication channels such as verbal content (i.e., text), voice, and facial expressions. It has become a vibrant and important research topic in natural…

Machine Learning · Computer Science 2022-02-23 Xingbo Wang , Jianben He , Zhihua Jin , Muqiao Yang , Yong Wang , Huamin Qu

Interactive lenses are useful tools for supporting the analysis of data in different ways. Most existing lenses are designed for 2D visualization and are operated using standard mouse and keyboard interaction. On the other hand, research on…

Graphics · Computer Science 2020-09-08 Sven Kluge , Stefan Gladisch , Uwe Freiherr von Lukas , Oliver Staadt , Christian Tominski

We present an autonomous scanning droplet cell platform designed for on-demand alloy electrodeposition and real-time electrochemical characterization for investigating the corrosion-resistance properties of multicomponent alloys. Automation…

Materials Science · Physics 2022-04-01 Brian DeCost , Howie Joress , Suchismita Sarker , Apurva Mehta , Jason Hattrick-Simpers

Modern machine learning often relies on optimizing a neural network's parameters using a loss function to learn complex features. Beyond training, examining the loss function with respect to a network's parameters (i.e., as a loss…

Machine learning (ML) offers powerful methods for detecting and modeling associations often in data with large feature spaces and complex associations. Many useful tools/packages (e.g. scikit-learn) have been developed to make the various…

Machine Learning · Computer Science 2022-06-27 Ryan J. Urbanowicz , Robert Zhang , Yuhan Cui , Pranshu Suri

The provision of fire services plays a vital role in ensuring the safety of residents' lives and property. The spatial layout of fire stations is closely linked to the efficiency of fire rescue operations. Traditional approaches have…

Human-Computer Interaction · Computer Science 2023-07-27 Longfei Chen , He Wang , Yang Ouyang , Yang Zhou , Naiyu Wang , Quan Li

A breakthrough in alloy design often requires comprehensive understanding in complex multi-component/multi-phase systems to generate novel material hypotheses. We introduce a modern data analytics workflow that leverages high-quality…

Materials Science · Physics 2019-04-10 Dongwon Shin , Yukinori Yamamoto , Michael P. Brady , Sangkeun Lee , J. Allen Haynes

Ensuring reliable data-driven decisions is crucial in domains where analytical accuracy directly impacts safety, compliance, or operational outcomes. Decision support in such domains relies on large tabular datasets, where manual analysis…

Software Engineering · Computer Science 2026-03-11 Arsham Gholamzadeh Khoee , Shuai Wang , Robert Feldt , Dhasarathy Parthasarathy , Yinan Yu

Agentic systems enable the intelligent use of research tooling, augmenting a researcher's ability to investigate and propose novel solutions to existing problems. Within Additive Manufacturing (AM), alloy selection and evaluation remains a…

Artificial Intelligence · Computer Science 2026-01-27 Peter Pak , Achuth Chandrasekhar , Amir Barati Farimani

Maintaining high data quality is crucial for reliable data analysis and machine learning (ML). However, existing data quality management tools often lack automation, interactivity, and integration with ML workflows. This demonstration paper…

Databases · Computer Science 2025-01-29 Mohamed Abdelaal , Samuel Lokadjaja , Arne Kreuz , Harald Schöning

Feature Models (FMs) are a mechanism to model variability among a family of closely related software products, i.e. a software product line (SPL). Analysis of FMs using formal methods can reveal defects in the specification such as…

Software Engineering · Computer Science 2016-04-04 Anjali Sree-Kumar , Elena Planas , Robert Clarisó

Representing source code in a generic input format is crucial to automate software engineering tasks, e.g., applying machine learning algorithms to extract information. Visualizing code representations can further enable human experts to…

Software Engineering · Computer Science 2023-07-28 Yuejun Guo , Seifeddine Bettaieb , Qiang Hu , Yves Le Traon , Qiang Tang

State-of-the-art Neural Network Architectures (NNAs) are challenging to design and implement efficiently in hardware. In the past couple of years, this has led to an explosion in research and development of automatic Neural Architecture…

Neural and Evolutionary Computing · Computer Science 2020-09-15 Philip Colangelo , Oren Segal , Alex Speicher , Martin Margala
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