Constraint Network Analysis (CNA): A Python Software Package for Efficiently Linking Biomacromolecular Structure, Flexibility, (Thermo-)Stability, and Function. - Christopher Pfleger; Prakash Chandra Rathi; Doris L. Klein; Sebastian Radestock; Holger Gohlke (J. Chem. Inf. Model., 2013)

CNA web server: rigidity theory-based thermal unfolding simulations of proteins for linking structure, (thermo-)stability, and function. - Dennis M. Krüger; Prakash Chandra Rathi; Christopher Pfleger; Holger Gohlke (Nucleic Acids Res., 2013)

Quality Matters: Extension of Clusters of Residues with Good Hydrophobic Contacts Stabilize (Hyper)Thermophilic Proteins. - Prakash Chandra Rathi; Hans Wolfgang Höffken; Holger Gohlke (J. Chem. Inf. Model., 2014)

VisualCNA: a GUI for interactive constraint network analysis and protein engineering for improving thermostability. - Prakash Chandra Rathi; Daniel Mulnaes; Holger Gohlke (Bioinform., 2015)

Application of Rigidity Theory to the Thermostabilization of Lipase A from Bacillus subtilis. - Prakash Chandra Rathi; Alexander Fulton; Karl-Erich Jaeger; Holger Gohlke (PLoS Comput. Biol., 2016)

Industry-Scale Orchestrated Federated Learning for Drug Discovery. - Martijn Oldenhof; Gergely Ács; Balázs Pejó; Ansgar Schuffenhauer; Nicholas Holway; Noé Sturm; Arne Dieckmann; Oliver Fortmeier; Eric Boniface; Clément Mayer; Arnaud Gohier; Peter Schmidtke; et al. (CoRR, 2022)

Industry-Scale Orchestrated Federated Learning for Drug Discovery. - Martijn Oldenhof; Gergely Ács; Balázs Pejó; Ansgar Schuffenhauer; Nicholas Holway; Noé Sturm; Arne Dieckmann; Oliver Fortmeier; Eric Boniface; Clément Mayer; Arnaud Gohier; Peter Schmidtke; et al. (AAAI, 2023)