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Deep learning (DL) allows computer models to learn, visualize, optimize, refine, and predict data. To understand its present state, examining the most recent advancements and applications of deep learning across various domains is…

Everyday we are exposed to various chemicals via food additives, cleaning and cosmetic products and medicines -- and some of them might be toxic. However testing the toxicity of all existing compounds by biological experiments is neither…

Machine Learning · Statistics 2015-03-06 Thomas Unterthiner , Andreas Mayr , Günter Klambauer , Sepp Hochreiter

Discovering new medicines is the hallmark of human endeavor to live a better and longer life. Yet the pace of discovery has slowed down as we need to venture into more wildly unexplored biomedical space to find one that matches today's high…

Artificial Intelligence · Computer Science 2022-02-16 Tri Minh Nguyen , Thin Nguyen , Truyen Tran

Artificial Intelligence is rapidly transforming materials science and engineering, offering powerful tools to navigate complexity, accelerate discovery, and optimize material design in ways previously unattainable. Driven by the…

In this work we used unsupervised machine learning methods in order to find possible clustering structures in superconducting materials data sets. We used the SuperCon database, as well as our own data sets complied from literature, in…

Superconductivity · Physics 2022-07-13 B. Roter , N. Ninkovic , S. V. Dordevic

Deep learning has led to a paradigm shift in artificial intelligence, including web, text and image search, speech recognition, as well as bioinformatics, with growing impact in chemical physics. Machine learning in general and deep…

We used the superconductors in the SuperCon database to construct element vectors and then perform unsupervised learning of their critical temperatures (T$_c$). Only the chemical composition of superconductors was used in this procedure. No…

Superconductivity · Physics 2020-07-15 B. Roter , S. V. Dordevic

We perform a large scale study of conventional superconducting materials using a machine-learning accelerated high-throughput workflow. We start by creating a comprehensive dataset of around 7000 electron-phonon calculations performed with…

Superconductivity · Physics 2023-07-21 Tiago F. T. Cerqueira , Antonio Sanna , Miguel A. L. Marques

Active learning has been increasingly applied to screening functional materials from existing materials databases with desired properties. However, the number of known materials deposited in the popular materials databases such as ICSD and…

The number and complexity of artificial intelligence (AI) applications is growing relentlessly. As a result, even with the many algorithmic and mathematical advances experienced over past decades as well as the impressive energy efficiency…

Machine Learning · Computer Science 2023-12-18 Jose Duato , Jose I. Mestre , Manuel F. Dolz , Enrique S. Quintana-Ortí

The world of 2D materials is rapidly expanding with new discoveries of stackable and twistable layered systems composed of lattices of different symmetries, orbital character, and structural motifs. Often, however, it is not clear a priori…

Mesoscale and Nanoscale Physics · Physics 2025-12-19 Daniel Kaplan , Alexander C. Tyner , Eva Y. Andrei , J. H. Pixley

Deep learning (DL) has recently attracted increasing interest to improve object type classification for automotive radar.In addition to high accuracy, it is crucial for decision making in autonomous vehicles to evaluate the reliability of…

Machine Learning · Computer Science 2021-06-11 Kanil Patel , William Beluch , Kilian Rambach , Adriana-Eliza Cozma , Michael Pfeiffer , Bin Yang

Deep Learning (DL) has become a crucial technology for Artificial Intelligence (AI). It is a powerful technique to automatically extract high-level features from complex data which can be exploited for applications such as computer vision,…

Computer Vision and Pattern Recognition · Computer Science 2019-06-10 Gael Kamdem De Teyou

The predictive capabilities of machine learning (ML) models used in materials discovery are typically measured using simple statistics such as the root-mean-square error (RMSE) or the coefficient of determination ($r^2$) between…

We present materials informatics approach to search for superconducting hydrogen compounds, which is based on a genetic algorithm and a genetic programming. This method consists of four stages: (i) search for stable crystal structures of…

Superconductivity · Physics 2019-11-13 Takahiro Ishikawa , Takashi Miyake , Katsuya Shimizu

The search for hydride compounds that exhibit high $T_c$ superconductivity has been extensively studied. Within the range of binary hydride compounds, the studies have been developed well including data-driven searches as a topic of…

We employed a machine-learning assisted approach to search for superconducting hydrides under ambient pressure within an extensive dataset comprising over 150 000 compounds. Our investigation yielded around 50 systems with transition…

Superconductivity · Physics 2024-03-21 Tiago F. T. Cerqueira , Yue-Wen Fang , Ion Errea , Antonio Sanna , Miguel A. L. Marques

The rapid advances in Deep Learning (DL) techniques have enabled rapid detection, localisation, and recognition of objects from images or videos. DL techniques are now being used in many applications related to agriculture and farming.…

Computer Vision and Pattern Recognition · Computer Science 2021-03-03 A S M Mahmudul Hasan , Ferdous Sohel , Dean Diepeveen , Hamid Laga , Michael G. K. Jones

The inverse design of materials with specific desired properties, such as high-temperature superconductivity, represents a formidable challenge in materials science due to the vastness of chemical and structural space. We present a guided…

Innovation in the physical layer of communication systems has traditionally been achieved by breaking down the transceivers into sets of processing blocks, each optimized independently based on mathematical models. Conversely, deep learning…

Information Theory · Computer Science 2022-05-04 Mathieu Goutay