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Machine Learning (ML) has recently been demonstrated to rival expert-level human accuracy in prediction and detection tasks in a variety of domains, including medicine. Despite these impressive findings, however, a key barrier to the full…

Artificial Intelligence · Computer Science 2021-07-01 D. Fompeyrine , E. S. Vorm , N. Ricka , F. Rose , G. Pellegrin

In recent years machine learning (ML) took bio- and cheminformatics fields by storm, providing new solutions for a vast repertoire of problems related to protein sequence, structure, and interactions analysis. ML techniques, deep neural…

Biomolecules · Quantitative Biology 2020-03-31 Marta M. Stepniewska-Dziubinska , Piotr Zielenkiewicz , Pawel Siedlecki

Machine learning models differ in terms of accuracy, computational/memory complexity, training time, and adaptability among other characteristics. For example, neural networks (NNs) are well-known for their high accuracy due to the quality…

Machine Learning · Computer Science 2020-08-05 Mahdi Nazemi , Amirhossein Esmaili , Arash Fayyazi , Massoud Pedram

Calabi-Yau links are specific $S^1$-fibrations over Calabi-Yau manifolds, when the link is 7-dimensional they exhibit both Sasakian and G2 structures. In this invited contribution to the DANGER proceedings, previous work exhaustively…

High Energy Physics - Theory · Physics 2024-01-23 Edward Hirst

Classical molecular dynamics (MD) simulations will be able to reach sampling in the second timescale within five years, producing petabytes of simulation data at current force field accuracy. Notwithstanding this, MD will still be in the…

Biomolecules · Quantitative Biology 2018-10-24 Adrià Pérez , Gerard Martínez-Rosell , Gianni De Fabritiis

Process-based hydrologic models are invaluable tools for understanding the terrestrial water cycle and addressing modern water resources problems. However, many hydrologic models are computationally expensive and, depending on the…

Geophysics · Physics 2025-02-11 Timothy Dai , Kate Maher , Zach Perzan

Network intrusion detection systems (NIDSs) play an important role in computer network security. There are several detection mechanisms where anomaly-based automated detection outperforms others significantly. Amid the sophistication and…

Science is currently at an age where there is more data than we know how to deal with. Machine learning (ML) is an emerging tool that is useful for drawing valuable science out of incomprehensibly large datasets and identifying complex…

High Energy Astrophysical Phenomena · Physics 2026-05-06 Laura Cotter , Antonio Martin-Carrillo , Joseph Fisher , Gabriel Finneran , Gregory Corcoran , Jennifer Lebron

The verification throughput is becoming a major challenge bottleneck, since the complexity and size of SoC designs are still ever increasing. Simply adding more CPU cores and running more tests in parallel will not scale anymore. This paper…

Machine Learning · Computer Science 2024-05-29 Deepak Narayan Gadde , Sebastian Simon , Djones Lettnin , Thomas Ziller

Machine Learning (ML) is accelerating the progress of materials prediction and classification, with particular success in CGNN designs. While classical ML methods remain accessible, advanced deep networks are still challenging to build and…

Other Condensed Matter · Physics 2025-02-04 Gavin Nop , Micah Mundy , Durga Paudyal , Jonathan Smith

Delivering meaningful uncertainty estimates is essential for a successful deployment of machine learning models in the clinical practice. A central aspect of uncertainty quantification is the ability of a model to return predictions that…

Computer Vision and Pattern Recognition · Computer Science 2023-03-03 Adrian Galdran , Johan Verjans , Gustavo Carneiro , Miguel A. González Ballester

The predictive accuracy of Machine Learning (ML) models of molecular properties depends on the choice of the molecular representation. Based on the postulates of quantum mechanics, we introduce a hierarchy of representations which meet…

Chemical Physics · Physics 2016-11-23 Bing Huang , O. Anatole von Lilienfeld

Cognitive map learners (CML) are a collection of separate yet collaboratively trained single-layer artificial neural networks (matrices), which navigate an abstract graph by learning internal representations of the node states, edge…

Neural and Evolutionary Computing · Computer Science 2024-05-01 Nathan McDonald , Anthony Dematteo

We construct heterotic standard models by compactifying on smooth Calabi-Yau three-folds in the presence of purely Abelian internal gauge fields. A systematic search over complete intersection Calabi-Yau manifolds with less than six Kahler…

High Energy Physics - Theory · Physics 2015-05-28 Lara B. Anderson , James Gray , Andre Lukas , Eran Palti

Beginning from a basic neural-network architecture, we test the potential benefits offered by a range of advanced techniques for machine learning, in particular deep learning, in the context of a typical classification problem encountered…

Data Analysis, Statistics and Probability · Physics 2020-06-03 Giles Chatham Strong

Machine learning (ML) in the representation of molecular-orbital-based (MOB) features has been shown to be an accurate and transferable approach to the prediction of post-Hartree-Fock correlation energies. Previous applications of MOB-ML…

Chemical Physics · Physics 2023-03-28 Lixue Cheng , Nikola B. Kovachki , Matthew Welborn , Thomas F. Miller

Error syndromes for heavy hexagonal code and other topological codes such as surface code have typically been decoded by using Minimum Weight Perfect Matching (MWPM) based methods. Recent advances have shown that topological codes can be…

Motivated by recent progress in the problem of numerical K\"ahler metrics, we survey machine learning techniques in this area, discussing both advantages and drawbacks. We then revisit the algebraic ansatz pioneered by Donaldson. Inspired…

High Energy Physics - Theory · Physics 2026-03-11 Carl Henrik Ek , Oisin Kim , Challenger Mishra

It is known that many Calabi-Yau manifolds form a connected web. The question of whether all Calabi-Yau manifolds form a single web depends on the degree of singularity that is permitted for the varieties that connect the distinct families…

High Energy Physics - Theory · Physics 2014-11-18 Philip Candelas , Rhys Davies

We study intersecting D6-branes in Calabi-Yau manifolds that are smooth hypersurfaces in weighted projective spaces. We develop the techniques for calculating intersection numbers between special Lagrangian sub-manifolds defined as fixed…

High Energy Physics - Theory · Physics 2009-05-01 Eran Palti