Guillaume Fraux

Scopus Author ID ORCID

Publication Activity (10 Years)

Years Active: 2017-2023
Publications (10 Years): 6

Top Venues

Open research Europe

Chemical Society reviews

The Journal of chemical physics

Journal of chemical information and modeling

École Polytechnique Fédérale de Lausanne

École Normale Supérieure (MSC)

This page only lists publications with an associated author ORCID identifier.

Affiliation History

École Polytechnique Fédérale de Lausanne Sep 01 2019

Switzerland

Postdoctoral researcher :: STI / IMX

Institut de Recherche de Chimie Paris Sep 01 2016 - Aug 31 2019

France

PhD student

Education History

École Normale Supérieure Sep 01 2012 - Aug 31 2016

France

MSC :: Chemistry

Publications

Alexander Goscinski, Victor Paul Principe, Guillaume Fraux, Sergei Kliavinek, Benjamin Aaron Helfrecht, Philip Loche, Michele Ceriotti, Rose Kathleen Cersonsky
scikit-matter : A Suite of Generalisable Machine Learning Methods Born out of Chemistry and Materials Science. Open research Europe 3 (2023)
Alexander Goscinski, Victor Paul Principe, Guillaume Fraux, Sergei Kliavinek, Benjamin Aaron Helfrecht, Philip Loche, Michele Ceriotti, Rose Kathleen Cersonsky
scikit-matter : A Suite of Generalisable Machine Learning Methods Born out of Chemistry and Materials Science. Open research Europe 3 (2023)
Alexander Goscinski, Victor Paul Principe, Guillaume Fraux, Sergei Kliavinek, Benjamin Aaron Helfrecht, Philip Loche, Michele Ceriotti, Rose Kathleen Cersonsky
scikit-matter : A Suite of Generalisable Machine Learning Methods Born out of Chemistry and Materials Science. Open research Europe 3 (2023)
Jonathan Fine, Matthew Muhoberac, Guillaume Fraux, Gaurav Chopra
DUBS: A Framework for Developing Directory of Useful Benchmarking Sets for Virtual Screening. Journal of chemical information and modeling 60 (9) (2020)
Marie Basire, Félix Mouhat, Guillaume Fraux, Amélie Bordage, Jean-Louis Hazemann, Marion Louvel, Riccardo Spezia, Sara Bonella, Rodolphe Vuilleumier
Fermi resonance in CO2: Mode assignment and quantum nuclear effects from first principles molecular dynamics. The Journal of chemical physics 146 (13) (2018)
Guillaume Fraux, François-Xavier Coudert, Anne Boutin, Alain H Fuchs
Forced intrusion of water and aqueous solutions in microporous materials: from fundamental thermodynamics to energy storage devices. Chemical Society reviews 46 (23) (2017)

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Publication Activity (10 Years)

Top Topics

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Guillaume Fraux