Open Boundary Modeling in Molecular Dynamics with Machine Learning. - Philipp Neumann; Niklas Wittmer (ICCS (6), 2020)

Massively Parallel Molecular-Continuum Flow Simulation with Error Control and Dynamic Ensemble Handling. - Vahid Jafari; Niklas Wittmer; Philipp Neumann (HPC Asia, 2022)

MaMiCo 2.0: An enhanced open-source framework for high-performance molecular-continuum flow simulation. - Piet Jarmatz; Helene Wittenberg; Vahid Jafari; Amartya Das Sharma; Felix Maurer; Niklas Wittmer; Philipp Neumann (SoftwareX, 2022)

Partially Adaptive Multichannel Joint Reduction of Ego-Noise and Environmental Noise. - Huajian Fang; Niklas Wittmer; Johannes Twiefel; Stefan Wermter; Timo Gerkmann (ICASSP, 2023)