Counting papers with at most 25 authors, so collaboration author lists do not stand in for the people here.
4 papers
Reactive molecular dynamics simulations of atenolol first steps degradation by 9CL6 ammonia monooxygenase
Pascal Brault, Matthieu Wolf, Yana Gouzi +2
The persistence of beta-blockers like atenolol in aquatic environments necessitates efficient remediation strategies, such as enzymatic biodegradation. This study employs reactive…
Periodic solutions for weakly damped systems
Camille Laurent, Ivonne Rivas
In this article, we investigate the existence and properties of time-periodic solutions for damped evolutionary partial differential equations subject to periodic forcing. Particul…
Reactive molecular dynamics approach to PFAS plasma oxidation in water
Axel Richard, Pascal Brault, Nicolas Froloff +3
This work establishes a protocol to study via Molecular Dynamics simulation the degradation of Per-and Polyfluoroalkyl Substances (PFAS) in water by hydroxyl radical. To achieve th…
A novel, finite-element-based framework for sparse data solution reconstruction and multiple choices
Wiera Bielajewa, Michelle Baxter, Perumal Nithiarasu
Digital twinning offers a capability of effective real-time monitoring and control, which are vital for cost-intensive experimental facilities, particularly the ones where extreme…