Agustí Lledós

According to our database, Agustí Lledós authored at least 5 papers between 2000 and 2019.

Collaborative distances:

• Dijkstra number of six.
• Erdős number of five.

2019

GARLEEK: Adding an extra flavor to ONIOM.

Jaime Rodríguez-Guerra Pedregal, Ignacio Funes-Ardoiz, Giuseppe Sciortino, José-Emilio Sánchez-Aparicio, Gregori Ujaque, Agustí Lledós, Jean-Didier Maréchal, Feliu Maseras

J. Comput. Chem., 2019

2018

Prediction of the interaction of metallic moieties with proteins: An update for protein-ligand docking techniques.

Giuseppe Sciortino, Jaime Rodríguez-Guerra Pedregal, Agustí Lledós, Eugenio Garribba, Jean-Didier Maréchal

J. Comput. Chem., 2018

2014

Assessing protein-ligand docking for the binding of organometallic compounds to proteins.

Elisabeth Ortega-Carrasco, Agustí Lledós, Jean-Didier Maréchal

J. Comput. Chem., 2014

2006

A DFT study on the relative affinity for oxygen of the and subunits of hemoglobin.

Jean-Didier Maréchal, Feliu Maseras, Agustí Lledós, Liliane Mouawad, David Pérahia

J. Comput. Chem., 2006

2000

Theoretical modeling of the heme group with a hybrid QM/MM method.

Jean-Didier Maréchal, Guada Barea, Feliu Maseras, Agustí Lledós, Liliane Mouawad, David Pérahia

J. Comput. Chem., 2000