Sergio Ruiz-Carmona

Dynamic undocking and the quasi-bound state as tools for drug discovery

F. J. Luque, X. Barril, B. Davis, 2016, Nature Chemistry.

Computational Design of Inhibitors Targeting the Catalytic β Subunit of Escherichia coli FOF1-ATP Synthase

X. Barril, Y. B. Ruiz-Blanco, E. García-Hernández, 2022, Antibiotics.

An investigation of structural stability in protein-ligand complexes reveals the balance between order and disorder

X. Barril, Sergio Ruiz-Carmona, Maciej Majewski, 2019, Communications Chemistry.

Oxygen Pathway Limitations in Patients With Chronic Thromboembolic Pulmonary Hypertension

J. Bogaert, P. Claus, C. Belge, 2021, Circulation.

rDock: A Fast, Versatile and Open Source Program for Docking Ligands to Proteins and Nucleic Acids

Xavier Barril, Nicolas Foloppe, Daniel Alvarez-Garcia, 2014, PLoS Comput. Biol..

The Carbon Footprint of Bioinformatics

M. Inouye, J. Marten, W. Saw, 2021, bioRxiv.

Are protein-ligand complexes robust structures?

Xavier Barril, Sergio Ruiz-Carmona, Maciej Majewski, 2018, bioRxiv.