Agustí Lledós

Publication Activity (10 Years)

Years Active: 2000-2019
Publications (10 Years): 2

Top Topics

Subcellular Localization

Protein Interaction

Top Venues

J. Comput. Chem.

Publications

Jaime Rodríguez-Guerra Pedregal, Ignacio Funes-Ardoiz, Giuseppe Sciortino, José-Emilio Sánchez-Aparicio, Gregori Ujaque, Agustí Lledós, Jean-Didier Maréchal, Feliu Maseras
GARLEEK: Adding an extra flavor to ONIOM. J. Comput. Chem. 40 (2) (2019)
Giuseppe Sciortino, Jaime Rodríguez-Guerra Pedregal, Agustí Lledós, Eugenio Garribba, Jean-Didier Maréchal
Prediction of the interaction of metallic moieties with proteins: An update for protein-ligand docking techniques. J. Comput. Chem. 39 (1) (2018)
Elisabeth Ortega-Carrasco, Agustí Lledós, Jean-Didier Maréchal
Assessing protein-ligand docking for the binding of organometallic compounds to proteins. J. Comput. Chem. 35 (3) (2014)
Jean-Didier Maréchal, Feliu Maseras, Agustí Lledós, Liliane Mouawad, David Pérahia
A DFT study on the relative affinity for oxygen of the and subunits of hemoglobin. J. Comput. Chem. 27 (12) (2006)
Jean-Didier Maréchal, Guada Barea, Feliu Maseras, Agustí Lledós, Liliane Mouawad, David Pérahia
Theoretical modeling of the heme group with a hybrid QM/MM method. J. Comput. Chem. 21 (4) (2000)