English
Related papers

Related papers: Similarity-Based Analysis of Atmospheric Organic C…

200 papers

Determining the stability of molecules and condensed phases is the cornerstone of atomistic modelling, underpinning our understanding of chemical and materials properties and transformations. Here we show that a machine learning model,…

The main components of an atmospheric model for numerical weather prediction are the dynamical core, which describes the resolved flow, and the physical parametrisations, which capture the effects of unresolved processes. Additionally,…

Numerical Analysis · Mathematics 2023-10-03 Alex Brown , Thomas M. Bendall , Ian Boutle , Thomas Melvin , Ben Shipway

The quality of air is closely linked with the life quality of humans, plantations, and wildlife. It needs to be monitored and preserved continuously. Transportations, industries, construction sites, generators, fireworks, and waste burning…

Machine Learning · Computer Science 2023-04-20 Amisha Gangwar , Sudhakar Singh , Richa Mishra , Shiv Prakash

This research investigates the use of artificial intelligence and machine learning techniques to predict the toxicity of nanoparticles, a pressing concern due to their pervasive use in various industries and the inherent challenges in…

Chemical Physics · Physics 2024-09-25 Iqra Yousaf

The metabolism is the motor behind the biological complexity of an organism. One problem of characterizing its large-scale structure is that it is hard to know what to compare it to. All chemical reaction systems are shaped by the same…

Molecular Networks · Quantitative Biology 2011-05-10 Petter Holme , Mikael Huss , Sang Hoon Lee

Atmospheric modeling has recently experienced a surge with the advent of deep learning. Most of these models, however, predict concentrations of pollutants following a data-driven approach in which the physical laws that govern their…

Applications · Statistics 2021-07-08 Javier Rubio-Herrero , Carlos Ortiz Marrero , Wai-Tong Louis Fan

Statistical learning algorithms are finding more and more applications in science and technology. Atomic-scale modeling is no exception, with machine learning becoming commonplace as a tool to predict energy, forces and properties of…

Chemical Physics · Physics 2020-12-09 Félix Musil , Michele Ceriotti

The determination of chemical mixture components is vital to a multitude of scientific fields. Oftentimes spectroscopic methods are employed to decipher the composition of these mixtures. However, the sheer density of spectral features…

Astrophysics of Galaxies · Physics 2024-08-29 Zachary T. P. Fried , Brett A. McGuire

Machine learning has been increasingly applied in climate modeling on system emulation acceleration, data-driven parameter inference, forecasting, and knowledge discovery, addressing challenges such as physical consistency, multi-scale…

Cloud computing offers an opportunity to run compute-resource intensive climate models at scale by parallelising model runs such that datasets useful to the exoplanet community can be produced efficiently. To better understand the…

Advances in computational chemistry have produced high-dimensional datasets on atmospherically relevant molecules. To aid exploration of such datasets, particularly for the study of atmospheric aerosol formation, we introduce PhiPlot: a…

Human-Computer Interaction · Computer Science 2026-03-13 Matias Loukojärvi , Ananth Mahadevan , Katsiaryna Haitsiukevich , Kai Puolamäki

Machine learning for molecular property prediction has focused largely on pure compounds, even though many practical applications depend on mixtures with intermolecular interactions. Recent work has expanded the availability of mixture…

Machine Learning · Computer Science 2026-05-29 Roel J. Leenhouts , Nathan K. Morgan , William Green , Jan G. Rittig , Florence H. Vermeire

A typical problem in air pollution epidemiology is exposure assessment for individuals for which health data are available. Due to the sparsity of monitoring sites and the limited temporal frequency with which measurements of air pollutants…

Development of air pollution models for large regions is a priority for population-based epidemiologic studies. The rapid development of big data information systems and machine learning algorithms have opened new grounds for refinements of…

Applications · Statistics 2022-11-18 Manuel Ribeiro

Atmospheric correction is a fundamental task in remote sensing because observations are taken either of the atmosphere or looking through the atmosphere. Atmospheric correction errors can significantly alter the spectral signature of the…

Image and Video Processing · Electrical Eng. & Systems 2022-03-23 Fangcao Xu , Jian Sun , Guido Cervone , Mark Salvador

With the recent advances in machine learning, creating agents that behave realistically in simulated air combat has become a growing field of interest. This survey explores the application of machine learning techniques for modeling air…

Machine Learning · Computer Science 2025-10-08 Patrick Ribu Gorton , Andreas Strand , Karsten Brathen

In this paper we statistically characterise the bio-aerosol background in an urban environment. To do this we measure concentration levels of naturally occurring microbiological material in the atmosphere over a two month period. Naturally…

Atmospheric and Oceanic Physics · Physics 2014-08-26 Milan Jamriska , Timothy C. DuBois , Alex Skvortsov

Aerosol-cloud interactions (ACI) pose the largest uncertainty for climate projections. Among many challenges of understanding ACI, the question of whether ACI is deterministic or stochastic has not been explicitly formulated and asked. Here…

Atmospheric and Oceanic Physics · Physics 2025-05-07 Xiang-Yu Li , Hailong Wang , TC Chakraborty , Armin Sorooshian , Luke D. Ziemba , Christiane Voigt , Kenneth Lee Thornhill

Real-time air pollution monitoring is a valuable tool for public health and environmental surveillance. In recent years, there has been a dramatic increase in air pollution forecasting and monitoring research using artificial neural…

Machine Learning · Computer Science 2022-11-11 Chen Lin , Safoora Yousefi , Elvis Kahoro , Payam Karisani , Donghai Liang , Jeremy Sarnat , Eugene Agichtein

Molecular odor prediction has great potential across diverse fields such as chemistry, pharmaceuticals, and environmental science, enabling the rapid design of new materials and enhancing environmental monitoring. However, current methods…

Machine Learning · Computer Science 2025-02-04 HongXin Xie , JianDe Sun , Yi Shao , Shuai Li , Sujuan Hou , YuLong Sun , Yuxiang Liu