James L McDonagh
5PUBLICATIONS
11CO-AUTHORS
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Publications (5)
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|Jul 12, 2023
Application of machine-learning algorithms to predict the transport properties of Mie fluids.Justinas Šlepavičius, Alessandro Patti, James L McDonagh
|Feb 09, 2023
Blinded Predictions and Post Hoc Analysis of the Second Solubility Challenge Data: Exploring Training Data and Feature Set Selection for Machine and Deep Learning Models.Jonathan G M Conn, James W Carter, Justin J A Conn
|Sep 25, 2019
Utilizing Machine Learning for Efficient Parameterization of Coarse Grained Molecular Force Fields.James L McDonagh, Ardita Shkurti, David J Bray
|Dec 07, 2017
Machine Learning of Dynamic Electron Correlation Energies from Topological Atoms.James L McDonagh, Arnaldo F Silva, Mark A Vincent
|Apr 13, 2017
Quantifying Electron Correlation of the Chemical Bond.James L McDonagh, Arnaldo F Silva, Mark A Vincent
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Frequent Collaborators
2 joint publications
Paul L A Popelier
1 joint publications
Richard L Anderson
1 joint publications
Edward O Pyzer-Knapp
1 joint publications
Vigneshwari Subramanian
1 joint publications
Ola Engkvist
1 joint publications
Antonio Llinas
1 joint publications
Stephen D Pickett
1 joint publications
David S Palmer
1 joint publications
Justinas Šlepavičius
1 joint publications
Alessandro Patti
