Paterson, L.: Computer aided design of stable and efficient OLEDs. Dissertation, Johannes Gutenberg-Universität, Mainz (2021)

Bischoff, C.: Molecular interactions between xanthan gum, psyllium, milk proteins and starches, and their implications on gluten-free bakery products. Master, Lund University, Lund, Sweden (2021)

Zillmer, H.: Interactions and phase behaviour of Ubiquilin-2. Master, Johannes Gutenberg-Universität, Mainz (2021)

Cortes Huerto, R.; Praprotnik, M.; Kremer, K.; Delle Site, L.: From adaptive resolution to molecular dynamics of open systems. European Physical Journal B 94 (9), 189 (2021)

Ferrari, F.; Zhao, Y.: The application of numerical topological invariants in simulations of knotted rings: A comprehensive Monte Carlo approach. Reviews in mathematical physics 33 (2), 2150005 (2021)

Bereau, T.: Computational compound screening of biomolecules and soft materials by molecular simulations. Modelling and Simulation in Materials Science and Engineering 29 (2), 023001 (2021)