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Revealing the dynamic evolution of interfacial water during Mg anodic dissolution

Xinchen Xu, Xingpeng Liao, Gaoning Shi, Yuyang Chen et al. • Journal of Magnesium and Alloys (2026)

Though magnesium alloys possess attractive mechanical properties, their applications are severely limited by galvanic corrosion, due to the rapid anodic dissolution and anomalous hydrogen evolution. In this work, well-tempered metadynamics ...

DOAJ Open Access (DOAJ) DOI: 10.1016/j.jma.2026.102217

Machine learning for quantum matter

Juan Carrasquilla • Advances in Physics X (2020)

Quantum matter, the research field studying phases of matter whose properties are intrinsically quantum mechanical, draws from areas as diverse as hard condensed matter physics, materials science, statistical mechanics, quantum information,...

OPENALEX cc-by DOI: https://doi.org/10.1080/23746149.2020.1797528

Accelerated Prediction of Terahertz Performance Metrics in GaN IMPATT Sources via Artificial Neural Networks

Santu Mondal, Sneha Ray, Aritra Acharyya, Rudra Sankar Dhar et al. • IEEE Access (2025)

This work investigates the application of artificial neural network (ANN)-based regression models to predict the static and dynamic characteristics of GaN impact avalanche transit time (IMPATT) sources in the terahertz (THz) frequency regim...

DOAJ Open Access (DOAJ) DOI: 10.1109/ACCESS.2025.3567410

Foundations of Machine Learning

• The MIT Press eBooks (2012)

Foundations of Machine LearningSoon we will embark on a theoretical study of AdaBoost in order to understand its properties, particularly its ability as a learning algorithm to generalize, that is, to make accurate predictions on data not s...

OPENALEX cc-by-nc-nd DOI: https://doi.org/10.7551/mitpress/8291.003.0006

Memristor Synapse—A Device-Level Critical Review

Sridhar Chandrasekaran, Yao-Feng Chang, Firman Mangasa Simanjuntak • Nanomaterials (2026)

The memristor has long been known as a nonvolatile memory technology alternative and has recently been explored for neuromorphic computing, owing to its capability to mimic the synaptic plasticity of the human brain. The architecture of a m...

DOAJ Open Access (DOAJ) DOI: 10.3390/nano16030179

Automated shape-based clustering of 3D immunoglobulin protein structures in chronic lymphocytic leukemia

Eleftheria Polychronidou, Ilias Kalamaras, Andreas Agathangelidis, Lesley-Ann Sutton et al. • BMC Bioinformatics (2018)

Abstract Background Although the etiology of chronic lymphocytic leukemia (CLL), the most common type of adult leukemia, is still unclear, strong evidence implicates antigen involvement in disease ontogeny and evolution. Primary and 3D stru...

DOAJ Open Access (DOAJ) DOI: 10.1186/s12859-018-2381-1

Machine Learning in Materials Science

Tim Mueller, Aaron Gilad Kusne, Rampi Ramprasad • Reviews in computational chemistry (2016)

This chapter addresses the role that data-driven approaches, especially machine learning methods, are expected to play in materials research in the immediate future. Machine learning, an important part of artificial intelligence, has made m...

OPENALEX DOI: https://doi.org/10.1002/9781119148739.ch4

Aerosol Optical Depth Retrieval from MODIS Using a Physically Informed Machine Learning Framework

Tianchen Liang, Linqing Zou, Qiaoning He, Lin Sun • Remote Sensing (2026)

Retrieving aerosol optical depth (AOD) over land remains challenging because the relatively weak aerosol signal in top-of-atmosphere (TOA) observations must be separated from strong and spatially heterogeneous surface reflectance. Here, we ...

DOAJ Open Access (DOAJ) DOI: 10.3390/rs18172862

Classification of bioactive peptides: A systematic benchmark of models and encodings

Edoardo Bizzotto, Guido Zampieri, Laura Treu, Pasquale Filannino et al. • Computational and Structural Biotechnology Journal (2024)

Bioactive peptides are short amino acid chains possessing biological activity and exerting physiological effects relevant to human health. Despite their therapeutic value, their identification remains a major problem, as it mainly relies on...

DOAJ Open Access (DOAJ) DOI: 10.1016/j.csbj.2024.05.040

Co-optimization of therapeutic antibody affinity and specificity using machine learning models that generalize to novel mutational space

Emily K. Makowski, Patrick C. Kinnunen, Jie Huang, Lina Wu et al. • Nature Communications (2022)

Optimising antibody properties such as affinity can be detrimental to other key properties. Here the authors use machine learning to simplify the identification of antibodies with co-optimal levels of affinity and specificity for a clinical...

DOAJ Open Access (DOAJ) DOI: 10.1038/s41467-022-31457-3

Machine learning in chemoinformatics and drug discovery

Yu‐Chen Lo, Stefano Rensi, Wen Torng, Russ Biagio Altman • Drug Discovery Today (2018)

Chemoinformatics is an established discipline focusing on extracting, processing and extrapolating meaningful data from chemical structures. With the rapid explosion of chemical 'big' data from HTS and combinatorial synthesis, machine learn...

OPENALEX cc-by DOI: https://doi.org/10.1016/j.drudis.2018.05.010 PMC: 6078794

Machine Learning Model Coupled with Graphical User Interface for Predicting Mechanical Properties of Flax Fiber

T. Nageshkumar, Prateek Shrivastava, L. Ammayapan, Manisha Jagadale et al. • Journal of Natural Fibers (2025)

Machine learning model coupled with graphical user interface was developed to predict mechanical properties of flax fiber. The experiment was conducted using test setup which applies constant rate of loading (CRL). Flax fiber was tested und...

DOAJ Open Access (DOAJ) DOI: 10.1080/15440478.2025.2502662

Surface circulation properties in the eastern Mediterranean emphasized using machine learning methods

G. Baaklini, G. Baaklini, R. El Hourany, M. Fakhri et al. • Ocean Science (2022)

The eastern Mediterranean surface circulation is highly energetic and composed of structures interacting stochastically. However, some main features are still debated, and the behavior of some fine-scale dynamics and their role in shaping t...

DOAJ Open Access (DOAJ) DOI: 10.5194/os-18-1491-2022

Machine learning in materials science

Jing Wei, Xuan Chu, Xiangyu Sun, Kun Xu et al. • InfoMat (2019)

Abstract Traditional methods of discovering new materials, such as the empirical trial and error method and the density functional theory (DFT)‐based method, are unable to keep pace with the development of materials science today due to the...

OPENALEX cc-by DOI: https://doi.org/10.1002/inf2.12028

On-board Clutch Slippage Detection and Diagnosis in Heavy Duty Machine

Elisabeth Källström, Tomas Olsson, John Lindström, Lars Hakansson et al. • International Journal of Prognostics and Health Management (2018)

In order to reduce unnecessary stops and expensive downtime originating from clutch failure of construction equipment machines; adequate real time sensor data measured on the machine in combination with feature extraction and classification...

DOAJ Open Access (DOAJ) DOI: doi:10.36001/ijphm.2018.v9i1.2693

Inferring Markovian quantum master equations of few-body observables in interacting spin chains

Francesco Carnazza, Federico Carollo, Dominik Zietlow, Sabine Andergassen et al. • New Journal of Physics (2022)

Full information about a many-body quantum system is usually out-of-reach due to the exponential growth—with the size of the system—of the number of parameters needed to encode its state. Nonetheless, in order to understand the complex phen...

DOAJ Open Access (DOAJ) DOI: 10.1088/1367-2630/ac7df6

Automated, economical, and environmentally-friendly asphalt mix design based on machine learning and multi-objective grey wolf optimization

Jian Liu, Fangyu Liu, Linbing Wang • Journal of Traffic and Transportation Engineering (English ed. Online) (2024)

The increasing impact of the greenhouse effect on ecosystems is prompting transportation agencies to seek methods for reducing CO2 emissions during pavement construction and maintenance. Additionally, the laboratory mix design process, whic...

DOAJ Open Access (DOAJ) DOI: 10.1016/j.jtte.2023.10.002

Optimization for Machine Learning

S. Sra, S. Nowozin, Stephen J. Wright • The MIT Press eBooks (2011)

An up-to-date account of the interplay between optimization and machine learning, accessible to students and researchers in both communities. The interplay between optimization and machine learning is one of the most important developments ...

OPENALEX DOI: https://doi.org/10.7551/mitpress/8996.001.0001