Exploració per autor "Fernández Recio, Juan"
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Docking-based identification of small-molecule binding sites at protein-protein interfaces
Rosell, Mireia; Fernández Recio, Juan (Elsevier, 2020)
Article
Accés obertProtein-protein interactions play an essential role in many biological processes, and their perturbation is a major cause of disease. The use of small molecules to modulate them is attracting increased attention, but protein ... -
LightDock: a new multi-scale approach to protein-protein docking
Jimenez Garcia, Brian; Roel Touris, Jorge; Romero Durana, Miguel; Vidal, Miquel; Jiménez González, Daniel; Fernández Recio, Juan (2018-01)
Article
Accés obertMotivation: Computational prediction of protein-protein complex structure by docking can provide structural and mechanistic insights for protein interactions of biomedical interest. However, current methods struggle with ... -
Prediction of binding energies upon mutation in 3D-structure-known complexes through PyDock scoring functions
Cuevas, Bruno; Romero, Miguel; Fernández Recio, Juan (Barcelona Supercomputing Center, 2017-05-04)
Text en actes de congrés
Accés obertThe main objective of this work is to build a simple but robust predictor of binding energy changes upon mutation, once structural information is provided. Three different tools are being employed: First, given the wild ... -
Structural basis for the dominant or recessive character of GLIALCAM mutations found in leukodystrophies
Elorza Vidal, Xabier; Xicoy Espaulella, Efren; Pla Casillanis, Adrià; Alonso Gardón, Marta; Gaitán Peñas, Héctor; Engel Pizcueta, Carolyn; Fernández Recio, Juan; Estévez, Raúl (Oxford University Press, 2020-04)
Article
Accés obertMegalencephalic leukoencephalopathy with subcortical cysts (MLC) is a type of leukodystrophy characterized by white matter edema, and it is caused mainly by recessive mutations in MLC1 and GLIALCAM genes. These variants ...