Computational investigation of functionalized carbenes on dinitrogen activation. - Justin K. Kirkland; Sophia K. Johnson; Konstantinos D. Vogiatzis (J. Comput. Chem., 2023)

MiMiCPy: An Efficient Toolkit for MiMiC-Based QM/MM Simulations. - Bharath Raghavan; Florian K. Schackert; Andrea Levy; Sophia K. Johnson; Emiliano Ippoliti; Davide Mandelli; Jógvan Magnus Haugaard Olsen; Ursula Rothlisberger; Paolo Carloni (J. Chem. Inf. Model., 2023)

Making Puzzle Pieces Fit or Reshaping MiMiC for Multiscale Simulations with CP2K and More. - Andrej Antalík; Andrea Levy; Sophia K. Johnson; Jógvan Magnus Haugaard Olsen; Ursula Rothlisberger (J. Chem. Inf. Model., 2025)