Nicolaï Gouraud
- Accelerating Molecular Dynamics Simulations with Foundation Neural Network Models using Multiple Time-Step and Distillation
2025/10/08 by Côme Cattin, Thomas Plé, Cattin, Côme +10 · 2 voices · 2 citations
Materials Science · Biochemistry, Genetics and Molecular Biology · Chemistry · #Chemical Physics (physics.chem-ph) #FOS: Physical sciences
- Velocity Jumps for Molecular Dynamics
2024/12/19 by Nicolaï Gouraud, Louis Lagardère, Olivier Adjoua +4 · 1 voice · 2 citations
Biochemistry, Genetics and Molecular Biology · Physics and Astronomy · #Hemoglobin structure and function #Protein Structure and Dynamics #Quantum chaos and dynamical systems