Computational Model of the Complex between GR113808 and the 5-HT4 Receptor Guided by Site-Directed Mutagenesis and the Crystal Structure of Rhodopsin. - María L. López-Rodríguez; Marta Murcia; Bellinda Benhamú; Mireia Olivella; Mercedes Campillo; Leonardo Pardo (J. Comput. Aided Mol. Des., 2001)

Benzimidazole derivatives. 4. The recognition of the voluminous substituent attached to the basic amino group of 5-HT4 receptor antagonists. - María L. López-Rodríguez; Bellinda Benhamú; Marta Murcia; Elsa Álvaro; Mercedes Campillo; Leonardo Pardo (J. Comput. Aided Mol. Des., 2003)

Binding of proteins to the minor groove of DNA: What are the structural and energetic determinants for kinking a basepair step?. - David Bosch 003; Mercedes Campillo; Leonardo Pardo (J. Comput. Chem., 2003)

Relation between sequence and structure in membrane proteins. - Mireia Olivella; Angel Gonzalez; Leonardo Pardo; Xavier Deupí (Bioinform., 2013)

Ligand Binding Determinants for Angiotensin II Type 1 Receptor from Computer Simulations. - Minos-Timotheos Matsoukas; Arnau Cordomí; Santiago Ríos; Leonardo Pardo; Theodore V. Tselios (J. Chem. Inf. Model., 2013)

TMalphaDB and TMbetaDB: web servers to study the structural role of sequence motifs in α-helix and β-barrel domains of membrane proteins. - Marc Perea; Ivar Lugtenburg; Eduardo Mayol; Arnau Cordomí; Xavier Deupí; Leonardo Pardo; Mireia Olivella (BMC Bioinform., 2015)

GPCRtm: An amino acid substitution matrix for the transmembrane region of class A G Protein-Coupled Receptors. - Santiago Ríos; Marta Fernandez; Gianluigi Caltabiano; Mercedes Campillo; Leonardo Pardo; Angel Gonzalez (BMC Bioinform., 2015)

The size matters? A computational tool to design bivalent ligands. - Laura Pérez-Benito; Andrew Henry; Minos-Timotheos Matsoukas; Laura Lopez; Daniel Pulido; Miriam Royo; Arnau Cordomí; Gary Tresadern; Leonardo Pardo (Bioinform., 2018)

Identifying human diamine sensors for death related putrescine and cadaverine molecules. - Cristina Izquierdo; José C. Gómez-Tamayo; Jean-Christophe Nebel; Leonardo Pardo; Angel Gonzalez (PLoS Comput. Biol., 2018)

Mechanisms Underlying Allosteric Molecular Switches of Metabotropic Glutamate Receptor 5. - Claudia Llinas del Torrent; Nil Casajuana-Martin; Leonardo Pardo; Gary Tresadern; Laura Pérez-Benito (J. Chem. Inf. Model., 2019)

A Single Point Mutation Blocks the Entrance of Ligands to the Cannabinoid CB2 Receptor via the Lipid Bilayer. - Nil Casajuana-Martin; Gemma Navarro; Angel Gonzalez; Claudia Llinas del Torrent; Marc Gómez-Autet; Aleix Quintana García; Rafael Franco; Leonardo Pardo (J. Chem. Inf. Model., 2022)

The Leu/Val6.51 Side Chain of Cannabinoid Receptors Regulates the Binding Mode of the Alkyl Chain of Δ9-Tetrahydrocannabinol. - Claudia Llinas del Torrent; Iu Raïch; Angel Gonzalez; Nil Casajuana-Martin; Jaume Lillo; Joan Biel Rebassa; Carlos Ferreiro-Vera; Verónica Sánchez de Medina; Rafael Franco; Gemma Navarro; Leonardo Pardo (J. Chem. Inf. Model., 2023)