rDock: A Fast, Versatile and Open Source Program for Docking Ligands to Proteins and Nucleic Acids. - Sergio Ruiz-Carmona; Daniel Alvarez-Garcia; Nicolas Foloppe; A. Beatriz Garmendia-Doval; Szilveszter Juhos; Peter Schmidtke; Xavier Barril; Roderick E. Hubbard; S. David Morley (PLoS Comput. Biol., 2014)

Docking-undocking combination applied to the D3R Grand Challenge 2015. - Sergio Ruiz-Carmona; Xavier Barril (J. Comput. Aided Mol. Des., 2016)

Binding mode prediction and MD/MMPBSA-based free energy ranking for agonists of REV-ERBα/NCoR. - Yvonne Westermaier; Sergio Ruiz-Carmona; Isabelle Theret; Françoise Perron-Sierra; Guillaume Poissonnet; Catherine Dacquet; Jean A. Boutin; Pierre Ducrot; Xavier Barril (J. Comput. Aided Mol. Des., 2017)

LigQ: A Webserver to Select and Prepare Ligands for Virtual Screening. - Leandro G. Radusky; Sergio Ruiz-Carmona; Carlos P. Modenutti; Xavier Barril; Adrian Gustavo Turjanski; Marcelo A. Marti (J. Chem. Inf. Model., 2017)