kontakteUR: transforming coordinates to chemical intuition to focus on essential interactions in biomolecular systems
Marvin Scherlo, Elias Wippermann, Torben F. Fürtges, Ricarda Künne, Aysa Yelboga, Fabian Ruetten, Markus Boeckmann, Udo Höweler, Till Rudack
kontakteUR transforms structural coordinates into a chemically informed contact space to analyze biomolecular interactions and their changes, enabling systematic comparison and functional insights.
bioRxiv · Jun 22, 2026 · PreprintBiochemistry