Browsing by Author Luque Garriga, F. Xavier

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Issue DateTitleAuthor(s)
Jan-2020Oleocantal del Aceite de Oliva Virgen Extra y sus efectos en procesos neurodegenerativosGonzález Pérez, Paula Inocencia
19-Feb-2020On the Binding of Congo Red to Amyloid FibrilsEspargaró Colomé, Alba; Llabrés Prat, Salomé; Saupe, Sven J.; Curutchet Barat, Carles E.; Luque Garriga, F. Xavier; Sabaté Lagunas, Raimon
13-Sep-2019On the usage of lipophilic descriptors for molecular similarity evaluationVázquez Lozano, Javier
25-Jul-2017Origin of the Base-Dependent Facial Selectivity in Annulation Reactions of Nazarov-Type Reagents with Unsaturated Indolo[2,3-a] quinolizidine LactamsEstarellas, Carolina; Arioli, Federica; Pérez Bosch, Maria; Are, Celeste; Hevia, David; Molins i Grau, Elies; Luque Garriga, F. Xavier; Bosch Cartes, Joan; Amat Tusón, Mercedes
2020Pharmacology and preclinical validation of a novel anticancer compound targeting PEPCK-MAragó, Marc; Moreno Felici, Juan; Abás Prades, Sònia; Rodríguez Arévalo, Sergio; Hyrossová, Petra; Figueras, Agnes; Viñals Canals, Francesc; Pérez, Belén; Loza, María Isabel; Brea, José; Latorre, Pedro; Carrodeguas, Jose A.; García-Roves, Pablo M. (Pablo Miguel); Galdeano, Carlos; Ginex, Tiziana; Luque Garriga, F. Xavier; Escolano Mirón, Carmen; Perales Losa, Carlos
10-Jul-2021Prediction of n-octanol/water partition coefficients and acidity constants (pKa) in the SAMPL7 blind challenge with the IEFPCM-MST modelViayna Gaza, Antonio; Pinheiro, Silvana de Souza; Curutchet Barat, Carles E.; Luque Garriga, F. Xavier; Zamora Ramírez, William J.
27-Nov-2019Prediction of the n‑octanol/water partition coefficients in the SAMPL6 blind challenge from MST continuum solvation calculationsZamora Ramírez, William J.; Pinheiro, Silvana de Souza; German, Kilian; Rafols Llach, Clara; Curutchet Barat, Carles E.; Luque Garriga, F. Xavier
12-Jun-2023Prediction of toluene/water partition coefficients in the SAMPL9 blind challenge: assessment of machine learning and IEF-PCM/MST continuum solvation modelsZamora Ramírez, William J.; Viayna Gaza, Antonio; Pinheiro, Silvana de Souza; Curutchet Barat, Carles E.; Bisbal, Laia; Ruiz, Rebeca; Ràfols Llach, Clara; Luque Garriga, F. Xavier
8-Nov-2012Role of PheE15 gate in ligand entry and nitric oxide detoxification function of Mycobacterium tuberculosis truncated hemoglobin NOliveira, Ana; Singh, Sandeep; Bidon-Chanal Badia, Axel; Forti, Flavio; Martí, Marcelo A.; Boechi, Leonardo; Estrín, Darío; Dikshit, Kanak L.; Luque Garriga, F. Xavier
4-May-2023Screening and biological evaluation of soluble Epoxide Hydrolase inhibitors: Assessing the role of hydrophobicity in the pharmacophore-guided search of novel hitsVázquez, Javier; Ginex, Tiziana; Herrero, Albert; Morisseau, Christophe; Hammock, Bruce D.; Luque Garriga, F. Xavier
7-Aug-2019Searching for selective scaffolds against Plasmodium falciparum glucose-6-phosphate dehydrogenase 6-phosphogluconolactonaseViayna Gaza, Antonio; Vílchez Puyo, David; Vázquez, Javier; Pérez-Benavente, Susana; Bautista, José Manuel; Luque Garriga, F. Xavier
1-Oct-2014Shogaol-huprine hybrids: Dual antioxidant and anticholinesterase agents with beta-amyloid and tau anti-aggregating propertiesPérez Areales, Francisco Javier; Di Pietro, O.; Espargaró Colomé, Alba; Vallverdú i Queralt, Anna; Galdeano Cantador, Carlos; Ragusa, Ilaria M.; Viayna, Elisabet; Guillou, Catherine; Clos, Victòria; Pérez Fernández, Belén; Sabaté Lagunas, Raimon; Lamuela Raventós, Rosa Ma.; Luque Garriga, F. Xavier; Muñoz-Torrero López-Ibarra, Diego
20-Aug-2015Short access to belt compounds with spatially close C=C bonds and their transannular reactionsCamps García, Pelayo; Gómez Nadal, Tània; Otermin Esteras, Ane; Font Bardia, Ma. Mercedes; Estarellas, Carolina; Luque Garriga, F. Xavier
12-Jul-2018Simulación molecular aplicada a inhibidores de 11β hidroxiesteroide deshidrogenasa tipo 1 y efecto de temperatura en CitoglobinaSeira Castán, Constantí
14-Sep-2015Stereocontrolled annulations of indolo[2,3-a]quinolizidine-derived lactams with a silylated Nazarov reagent. Access to allo and epiallo yohimbine-type derivativesArioli, Federica; Pérez Bosch, Maria; Are, Celeste; Estarellas, Carolina; Luque Garriga, F. Xavier; Bosch Cartes, Joan; Amat Tusón, Mercedes
26-Oct-2010Structural and Dynamical Aspects of Hemeproteins from Molecular Simulations (Seminaris de Recerca 2010)Luque Garriga, F. Xavier
21-Apr-2017Structural and energetic study of cation-p-cation interactions in proteinsPinheiro, Silvana de Souza; Soteras, Ignacio; Gelpí Buchaca, Josep Lluís; Dehez, François; Chipot, Christophe; Luque Garriga, F. Xavier; Curutchet Barat, Carles E.
12-Aug-2020Structural and functional properties of Antarctic fish cytoglobins-1: Cold-reactivity in multi-ligand reactionsGiordano, Daniela; Pesce, Alessandra; Vermeylen, Stijn; Abbruzzetti, Stefania; Nardini, Marco; Marchesani, Francesco; Berghmans, Herald; Seira Castán, Constantí; Bruno, Stefano; Luque Garriga, F. Xavier; di Prisco, Guido; Ascenzii, Paolo; Dewilde, Sylvia; Bolognesi, Martino; Viappiani, Cristiano; Verde, Cinzia
5-Jun-2021Structural basis of the selective activation of enzyme isoforms: Allosteric response to activators of b1- and b2-containing AMPK complexesAledavood, Elnaz; Forte, Alessia; Estarellas, Carolina; Luque Garriga, F. Xavier
6-Nov-2014Structural model of the hUbA1-UbcH10 quaternary complex: In silico and experimental analysis of the protein-protein interactions between E1, E2 and ubiquitinCorreale, Stefania; de Paola, Ivan; Morgillo, Carmine Marco; Federico, Antonella; Zaccaro, Laura; Pallante, Pierlorenzo; Galeone, Aldo; Fusco, Alfredo; Pedone, Emilia; Luque Garriga, F. Xavier; Catalanotti, Bruno