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Machine learning algorithms typically rely on optimization subroutines and are well-known to provide very effective outcomes for many types of problems. Here, we flip the reliance and ask the reverse question: can machine learning…

Machine Learning · Computer Science 2019-07-30 Jesus A. De Loera , Jamie Haddock , Anna Ma , Deanna Needell

We present a novel application of the machine learning / artificial intelligence method called boosted decision trees to estimate physical quantities on field programmable gate arrays (FPGA). The software package fwXmachina features a new…

High Energy Physics - Experiment · Physics 2023-04-12 Benjamin Carlson , Quincy Bayer , Tae Min Hong , Stephen Roche

In recent years, machine learning has been proposed as a promising strategy to build accurate scoring functions for computational docking finalized to numerically empowered drug discovery. However, the latest studies have suggested that…

Quantitative Methods · Quantitative Biology 2023-02-17 F. Pellicani , D. Dal Ben , A. Perali , S. Pilati

Recursive neural networks (RvNN) have been shown useful for learning sentence representations and helped achieve competitive performance on several natural language inference tasks. However, recent RvNN-based models fail to learn simple…

Computation and Language · Computer Science 2021-04-13 Atul Sahay , Ayush Maheshwari , Ritesh Kumar , Ganesh Ramakrishnan , Manjesh Kumar Hanawal , Kavi Arya

This paper proposes a hybrid framework combining LSTM (Long Short-Term Memory) networks with LightGBM and CatBoost for stock price prediction. The framework processes time-series financial data and evaluates performance using seven models:…

Machine Learning · Computer Science 2025-05-30 Chang Yu , Fang Liu , Jie Zhu , Shaobo Guo , Yifan Gao , Zhongheng Yang , Meiwei Liu , Qianwen Xing

Toxicity analysis and prediction are of paramount importance to human health and environmental protection. Existing computational methods are built from a wide variety of descriptors and regressors, which makes their performance analysis…

Quantitative Methods · Quantitative Biology 2017-04-03 Kedi Wu , Guo-Wei Wei

Tree-based models have proven to be an effective solution for web ranking as well as other problems in diverse domains. This paper focuses on optimizing the runtime performance of applying such models to make predictions, given an…

Databases · Computer Science 2013-04-29 Nima Asadi , Jimmy Lin , Arjen P. de Vries

Boosting algorithms are frequently used in applied data science and in research. To date, the distinction between boosting with either gradient descent or second-order Newton updates is often not made in both applied and methodological…

Machine Learning · Statistics 2020-10-21 Fabio Sigrist

The analysis of complex computer simulations, often involving functional data, presents unique statistical challenges. Conventional regression methods, such as function-on-function regression, typically associate functional outcomes with…

Methodology · Statistics 2026-02-11 R. Jacob Andros , Rajarshi Guhaniyogi , Devin Francom , Donatella Pasqualini

Classical models for supervised machine learning, such as decision trees, are efficient and interpretable predictors, but their quality is highly dependent on the particular choice of input features. Although neural networks can learn…

Machine Learning · Computer Science 2025-10-17 Gabriel Poesia , Georgia Gabriela Sampaio

Two of the most popular modelling paradigms in computer vision are feed-forward neural networks (FFNs) and probabilistic graphical models (GMs). Various connections between the two have been studied in recent works, such as e.g. expressing…

Machine Learning · Statistics 2017-10-31 Dmitrij Schlesinger

Tree-based machine learning models such as random forests, decision trees, and gradient boosted trees are the most popular non-linear predictive models used in practice today, yet comparatively little attention has been paid to explaining…

Neural networks trained on standard image classification data sets are shown to be less resistant to data set bias. It is necessary to comprehend the behavior objective function that might correspond to superior performance for data with…

Machine Learning · Computer Science 2022-11-16 Gnyanesh Bangaru , Lalith Bharadwaj Baru , Kiran Chakravarthula

Decision trees (DTs) and their random forest (RF) extensions are workhorses of classification and regression in Euclidean spaces. However, algorithms for learning in non-Euclidean spaces are still limited. We extend DT and RF algorithms to…

Machine Learning · Computer Science 2025-06-10 Philippe Chlenski , Quentin Chu , Raiyan R. Khan , Kaizhu Du , Antonio Khalil Moretti , Itsik Pe'er

Accurate and adaptive network throughput prediction is essential for latency-sensitive and bandwidth-intensive applications in 5G and emerging 6G networks. However, most existing methods rely on centralized training with uniformly collected…

Distributed, Parallel, and Cluster Computing · Computer Science 2025-08-13 Yuvraj Dutta , Soumyajit Chatterjee , Sandip Chakraborty , Basabdatta Palit

Convolutional Neural Networks (CNNs) are frequently and successfully used in medical prediction tasks. They are often used in combination with transfer learning, leading to improved performance when training data for the task are scarce.…

Computer Vision and Pattern Recognition · Computer Science 2026-01-22 Marta Oliveira , Rick Wilming , Benedict Clark , Céline Budding , Fabian Eitel , Kerstin Ritter , Stefan Haufe

With the ever-increasing complexity of neural language models, practitioners have turned to methods for understanding the predictions of these models. One of the most well-adopted approaches for model interpretability is feature-based…

Computation and Language · Computer Science 2021-06-10 Muhammad Bilal Zafar , Michele Donini , Dylan Slack , Cédric Archambeau , Sanjiv Das , Krishnaram Kenthapadi

We analyze the accuracy of traffic simulations metamodels based on neural networks and gradient boosting models (LightGBM), applied to traffic optimization as fitness functions of genetic algorithms. Our metamodels approximate outcomes of…

Machine Learning · Computer Science 2018-12-12 Paweł Gora , Maciej Brzeski , Marcin Możejko , Arkadiusz Klemenko , Adrian Kochański

We analyze the performance of graph neural network (GNN) architectures from the perspective of random graph theory. Our approach promises to complement existing lenses on GNN analysis, such as combinatorial expressive power and worst-case…

Machine Learning · Computer Science 2023-10-12 Drake Brown , Trevor Garrity , Kaden Parker , Jason Oliphant , Stone Carson , Cole Hanson , Zachary Boyd

In today's machine learning world for tabular data, XGBoost and fully connected neural network (FCNN) are two most popular methods due to their good model performance and convenience to use. However, they are highly complicated, hard to…

Methodology · Statistics 2024-10-28 Linwei Hu , Ye Jin Choi , Vijayan N. Nair