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A blueprint for high affinity SARS-CoV-2 Mpro inhibitors from activity-based compound library screening guided by analysis of protein dynamics2020 bioRxiv (Cold Spring Harbor Laboratory) preprint Computer Science Computational Drug Discovery Methods Open access
Jonas Goßen, Simone Albani, Anton Hanke, Benjamin Philipp Joseph, Cathrine C. Bergh, Maria Kuzikov, +14 more
5citations -
Fi-score: a novel approach to characterise protein topology and aid in drug discovery studies2020 bioRxiv (Cold Spring Harbor Laboratory) preprint Computer Science Computational Drug Discovery Methods Open access
Austė Kanapeckaitė, Claudia Beaurivage, MATTHEW J. HANCOCK, Erik Verschueren
2citations -
Polynomial pathwidth for graphs vertex-coverable by few shortest paths and algorithms for quasi-shortest path covers2026 arXiv (Cornell University) preprint Computer Science Advanced Graph Theory Research Open access
Li-Hsuan Chen, Florent Foucaud, Ling-Ju Hung, Ralf Klasing, Lucas Lorieau, Peter Rossmanith
0citations
13 results