Daniel Borgis

Publication Activity (10 Years)

Years Active: 2018-2023
Publications (10 Years): 9

Top Topics

Density Functional Theory

Electron Transfer

Convolutional Neural Network

Top Venues

Chemical science

The Journal of chemical physics

Journal of chemical theory and computation

The journal of physical chemistry letters

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

Publications

Daniel Borgis, Damien Laage, Luc Belloni, Guillaume Jeanmairet
Dielectric response of confined water films from a classical density functional theory perspective. Chemical science 14 (40) (2023)
Cristina E González-Espinoza, Christopher A Rumble, Daniel Borgis, Tomasz Adam Wesołowski
Quantifying Fluctuations of Average Solvent Environments for Embedding Calculations. Journal of chemical theory and computation 18 (2) (2022)
Daniel Borgis, Sohvi Luukkonen, Luc Belloni, Guillaume Jeanmairet
Accurate prediction of hydration free energies and solvation structures using molecular density functional theory with a simple bridge functional. The Journal of chemical physics 155 (2) (2021)
Guillaume Jeanmairet, Maximilien Levesque, Daniel Borgis
Tackling Solvent Effects by Coupling Electronic and Molecular Density Functional Theory. Journal of chemical theory and computation 16 (11) (2020)
Daniel Borgis, Sohvi Luukkonen, Luc Belloni, Guillaume Jeanmairet
Simple Parameter-Free Bridge Functionals for Molecular Density Functional Theory. Application to Hydrophobic Solvation. The journal of physical chemistry. B 124 (31) (2020)
Sohvi Luukkonen, Luc Belloni, Daniel Borgis, Maximilien Levesque
Predicting Hydration Free Energies of the FreeSolv Database of Drug-like Molecules with Molecular Density Functional Theory. Journal of chemical information and modeling 60 (7) (2020)
Guillaume Jeanmairet, Benjamin Rotenberg, Daniel Borgis, Mathieu Salanne
Study of a water-graphene capacitor with molecular density functional theory. The Journal of chemical physics 151 (12) (2019)
Daniel Borgis, Luc Belloni, Maximilien Levesque
What Does Second-Harmonic Scattering Measure in Diluted Electrolytes? The journal of physical chemistry letters 9 (13) (2018)
Guillaume Jeanmairet, Benjamin Rotenberg, Maximilien Levesque, Daniel Borgis, Mathieu Salanne
A molecular density functional theory approach to electron transfer reactions. Chemical science 10 (7) (2018)