José-Emilio Sánchez-Aparicio
8PUBLICATIONS
30CO-AUTHORS
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Publications (8)
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|Jun 23, 2025
BioBrigit, a Hybrid Machine Learning and Knowledge-Based Approach to Model Metal Pathways in Proteins: Application to a Dicopper Tyrosinase.Raúl Fernández-Díaz, Lorena Roldán-Martín, Mariona Sodupe
|Jul 27, 2022
Influence of Association on Binding of Disaccharides to YKL-39 and hHyal-1 Enzymes.Agnieszka Krzemińska, José-Emilio Sánchez-Aparicio, Jean-Didier Maréchal
|Feb 11, 2022
Successes and challenges in multiscale modelling of artificial metalloenzymes: the case study of POP-Rh2 cyclopropanase.José-Emilio Sánchez-Aparicio, Giuseppe Sciortino, Eric Mates-Torres
|Jun 02, 2021
Hybrid Cyclobutane/Proline-Containing Peptidomimetics: The Conformational Constraint Influences Their Cell-Penetration Ability.Ona Illa, Jimena Ospina, José-Emilio Sánchez-Aparicio
|Oct 08, 2020
Investigating Potential Inhibitory Effect of Uncaria tomentosa (Cat's Claw) against the Main Protease 3CLpro of SARS-CoV-2 by Molecular Modeling.Andres F Yepes-Pérez, Oscar Herrera-Calderon, José-Emilio Sánchez-Aparicio
|Jul 03, 2019
GPathFinder: Identification of Ligand-Binding Pathways by a Multi-Objective Genetic Algorithm.José-Emilio Sánchez-Aparicio, Giuseppe Sciortino, Daniel Viladrich Herrmannsdoerfer
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Frequent Collaborators
7 joint publications
Jean-Didier Maréchal
3 joint publications
Jaime Rodríguez-Guerra Pedregal
3 joint publications
Giuseppe Sciortino
1 joint publications
Ignacio Funes-Ardoiz
1 joint publications
Feliu Maseras
1 joint publications
Alys Peisley
1 joint publications
James R Ketudat Cairns
1 joint publications
Sebastien Fort
1 joint publications
Mercedes Alfonso-Prieto
1 joint publications
Carme Rovira
