Local hartree-fock orbitals using a three-level optimization strategy for the energy. - Ida-Marie Høyvik; Branislav Jansik; Kasper Kristensen; Poul Jørgensen (J. Comput. Chem., 2013)

Pipek-Mezey localization of occupied and virtual orbitals. - Ida-Marie Høyvik; Branislav Jansik; Poul Jørgensen (J. Comput. Chem., 2013)

Performance, Power Consumption and Thermal Behavioral Evaluation of the DGX-2 Platform. - Matej Spetko; Lubomir Riha; Branislav Jansik (PARCO, 2019)

Toward highly parallel loading of unstructured meshes. - Ondrej Meca; Lubomír Ríha; Branislav Jansik; Tomás Brzobohatý (Adv. Eng. Softw., 2022)

Tunable and Portable Extreme-Scale Drug Discovery Platform at Exascale: the LIGATE Approach. - Gianluca Palermo; Gianmarco Accordi; Davide Gadioli; Emanuele Vitali; Cristina Silvano; Bruno Guindani; Danilo Ardagna; Andrea Rosario Beccari; Domenico Bonanni; Carmine Talarico; Filippo Lunghini; Jan Martinovic; et al. (CF, 2023)

LIGATE - LIgand Generator and portable drug discovery platform AT Exascale. - Gianluca Palermo; Gianmarco Accordi; Davide Gadioli; Yuedong Zhang; Emanuele Vitali; Bruno Guindani; Danilo Ardagna; Cristina Silvano; Andrea Rosario Beccari; Domenico Bonanni; Carmine Talarico; Filippo Lunghini; et al. (CF (Companion), 2024)

HyperQueue: Efficient and ergonomic task graphs on HPC clusters. - Jakub Beránek; Ada Böhm; Gianluca Palermo; Jan Martinovic; Branislav Jansik (SoftwareX, 2024)