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Showing 20 of 285 academic articles

Machine Learning in Virtual Screening

James L. Melville, Edmund K. Burke, Jonathan D. Hirst • Combinatorial Chemistry & High Throughput Screening (2009)

In this review, we highlight recent applications of machine learning to virtual screening, focusing on the use of supervised techniques to train statistical learning algorithms to prioritize databases of molecules as active against a partic...

OPENALEX DOI: https://doi.org/10.2174/138620709788167980

Interpretable machine learning for predicting compression index of clays using SHAP and gradient boosting models

Khaled Hamdaoui, Ali Benzaamia, Billal Sari Ahmed, Mohamed Elhebib Guellil et al. • Journal of Engineering and Applied Science (2025)

Abstract This study introduces a novel, interpretable machine learning framework for predicting the compression index (Cc) of clay soils by integrating three advanced gradient boosting algorithms—XGBoost, CatBoost, and LightGBM—with SHapley...

DOAJ Open Access (DOAJ) DOI: 10.1186/s44147-025-00727-4

Integrating BIM, Machine Learning, and PMBOK for Green Project Management in Saudi Arabia: A Framework for Energy Efficiency and Environmental Impact Reduction

Maher Abuhussain, Ali Hussain Alhamami, Khaled Almazam, Omar Humaidan et al. • Buildings (2025)

This study introduces a comprehensive framework combining building information modeling (BIM), project management body of knowledge (PMBOK), and machine learning (ML) to optimize energy efficiency and reduce environmental impacts in Riyadh’...

DOAJ Open Access (DOAJ) DOI: 10.3390/buildings15173031

Machine Learning in Compiler Optimization

Zheng Wang, Michael F. P. O’boyle • Proceedings of the IEEE (2018)

In the last decade, machine-learning-based compilation has moved from an obscure research niche to a mainstream activity. In this paper, we describe the relationship between machine learning and compiler optimization and introduce the main ...

OPENALEX Open Access DOI: https://doi.org/10.1109/jproc.2018.2817118

Evaluation of GCC optimization parameters

Rodrigo D. Escobar, Alekya R. Angula, Mark Corsi • Ingenierías USBMed (2012)

Compile-time optimization of code can result in significant performance gains. The amount of these gains varies widely depending upon the code being optimized, the hardware being compiled for, the specific performance increase attempted (e....

DOAJ Open Access (DOAJ)

Machine learning in polymer informatics

Wuxin Sha, Yan Li, Shun Tang, Jie Tian et al. • InfoMat (2021)

Abstract Polymers have been widely used in energy storage, construction, medicine, aerospace, and so on. However, the complexity of chemical composition and morphology of polymers has brought challenges to their development. Thanks to the i...

OPENALEX cc-by DOI: https://doi.org/10.1002/inf2.12167

Mathematics for Machine Learning

Marc Peter Deisenroth, A. Aldo Faisal, Cheng Soon Ong • Cambridge University Press eBooks (2020)

The fundamental mathematical tools needed to understand machine learning include linear algebra, analytic geometry, matrix decompositions, vector calculus, optimization, probability and statistics. These topics are traditionally taught in d...

OPENALEX DOI: https://doi.org/10.1017/9781108679930

Physics-Informed Machine Learning

Steven L. Brunton, J. Nathan Kutz • Cambridge University Press eBooks (2022)

Data-driven discovery is revolutionizing how we model, predict, and control complex systems. Now with Python and MATLAB®, this textbook trains mathematical scientists and engineers for the next generation of scientific discovery by offering...

OPENALEX DOI: https://doi.org/10.1017/9781009089517.019

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

An intelligent machine learning paradigm for gyrotactic micro-organism-induced squeezing flow of Eyring–Powell hybrid nanofluids with entropy generation

A. Imran, Muna Elsadig, Jongsuk Ro • AIP Advances (2026)

A novel unsteady squeezing flow of a non-Newtonian ternary hybrid nanofluid is investigated by focusing Eyring–Powell fluid rheology in an infinite channel. The nanofluid consists of AA1072, AA1075, and ZrO2 nanoparticles suspended in blood...

DOAJ Open Access (DOAJ) DOI: 10.1063/5.0337148

PosturAll: A Posture Assessment Software for Children

Ana Beatriz Neves, Rodrigo Martins, Nuno Matela, Tiago Atalaia • Bioengineering (2023)

From an early age, people are exposed to risk factors that can lead to musculoskeletal disorders like low back pain, neck pain and scoliosis. Medical screenings at an early age might minimize their incidence. The study intends to improve a ...

DOAJ Open Access (DOAJ) DOI: 10.3390/bioengineering10101171