Simon J. Bennie

Publication Activity (10 Years)

Years Active: 2019-2023
Publications (10 Years): 6

Top Topics

Virtual Reality

Molecular Dynamics

Top Venues

J. Comput. Chem.

J. Chem. Inf. Model.

Publications

Simon J. Bennie, Martina Maritan, Jonathon Gast, Marc Loschen, Daniel Gruffat, Roberta Bartolotta, Sam Hessenauer, Edgardo Leija, Steve McCloskey
A Virtual and Mixed Reality Platform for Molecular Design & Drug Discovery - Nanome Version 1.24. MolVA@EuroVis (2023)
Alexander D. Jamieson-Binnie, Michael B. O'Connor, Jonathan Barnoud, Mark D. Wonnacott, Simon J. Bennie, David R. Glowacki
Narupa iMD: A VR-Enabled Multiplayer Framework for Streaming Interactive Molecular Simulations. SIGGRAPH Immersive Pavilion (2020)
Oscar A. Douglas-Gallardo, Ian Shepherd, Simon J. Bennie, Kara E. Ranaghan, Adrian J. Mulholland, Esteban Vöhringer-Martinez
Electronic structure benchmark calculations of CO2 fixing elementary chemical steps in RuBisCO using the projector-based embedding approach. J. Comput. Chem. 41 (24) (2020)
Silvia Amabilino, Lars A. Bratholm, Simon J. Bennie, Alain C. Vaucher, Markus Reiher, David R. Glowacki
Training neural nets to learn reactive potential energy surfaces using interactive quantum chemistry in virtual reality. CoRR (2019)
Michael B. O'Connor, Simon J. Bennie, Helen M. Deeks, Alexander Jamieson-Binnie, Alex J. Jones, Robin J. Shannon, Rebecca Walters, Thomas J. Mitchell, Adrian J. Mulholland, David R. Glowacki
An open-source multi-person virtual reality framework for interactive molecular dynamics: from quantum chemistry to drug binding. CoRR (2019)
Kara E. Ranaghan, Darya Shchepanovska, Simon J. Bennie, Narin Lawan, Stephen J. Macrae, Jolanta Zurek, Frederick R. Manby, Adrian J. Mulholland
Projector-Based Embedding Eliminates Density Functional Dependence for QM/MM Calculations of Reactions in Enzymes and Solution. J. Chem. Inf. Model. 59 (5) (2019)