Theodorus de Bruin

Publication Activity (10 Years)

Years Active: 2024-2024
Publications (10 Years): 2

Top Topics

Molecular Dynamics Simulations

Virtual Reality

Top Venues

Journal of chemical theory and computation

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

Publications

Loïc Dumortier, Céline Chizallet, Benoit Creton, Theodorus de Bruin, Toon Verstraelen
Managing Expectations and Imbalanced Training Data in Reactive Force Field Development: An Application to Water Adsorption on Alumina. Journal of chemical theory and computation (2024)
Loïc Dumortier, Céline Chizallet, Benoit Creton, Theodorus de Bruin, Toon Verstraelen
Managing Expectations and Imbalanced Training Data in Reactive Force Field Development: An Application to Water Adsorption on Alumina. Journal of chemical theory and computation 20 (9) (2024)