Comparison of three enveloping distribution sampling Hamiltonians for the estimation of multiple free energy differences from a single simulation. - Clara D. Christ; Wilfred F. van Gunsteren (J. Comput. Chem., 2009)

Basic ingredients of free energy calculations: A review. - Clara D. Christ; Alan E. Mark; Wilfred F. van Gunsteren (J. Comput. Chem., 2010)

Architecture, implementation and parallelisation of the GROMOS software for biomolecular simulation. - Nathan Schmid; Clara D. Christ; Markus Christen; Andreas P. Eichenberger; Wilfred F. van Gunsteren (Comput. Phys. Commun., 2012)

Mining Electronic Laboratory Notebooks: Analysis, Retrosynthesis, and Reaction Based Enumeration. - Clara D. Christ; Matthias Zentgraf; Jan M. Kriegl (J. Chem. Inf. Model., 2012)

Accuracy Assessment and Automation of Free Energy Calculations for Drug Design. - Clara D. Christ; Thomas Fox (J. Chem. Inf. Model., 2014)

Collaborating to improve the use of free-energy and other quantitative methods in drug discovery. - Bradley Sherborne; Veerabahu Shanmugasundaram; Alan C. Cheng; Clara D. Christ; Renee L. DesJarlais; José S. Duca; Richard A. Lewis; Deborah A. Loughney; Eric S. Manas; Georgia B. McGaughey; Catherine E. Peishoff; Herman van Vlijmen (J. Comput. Aided Mol. Des., 2016)

Benchmarking Cross-Docking Strategies in Kinase Drug Discovery. - David Schaller 002; Clara D. Christ; John D. Chodera; Andrea Volkamer (J. Chem. Inf. Model., 2024)