Hybrid parallelization of a multi-tree path search algorithm: Application to highly-flexible biomolecules. - Alejandro Estaña; Kevin Molloy; Marc Vaisset; Nathalie Sibille; Thierry Siméon; Pau Bernadó; Juan Cortés (Parallel Comput., 2018)

The real-time TDDFT code "Quantum Dissipative Dynamics" on a GPU. - Phuong Mai Dinh; Jordan Heraud; Alejandro Estaña; Marc Vincendon; Paul-Gerhard Reinhard; Eric Suraud (Comput. Phys. Commun., 2024)