Browsing by Author Luque Garriga, F. Xavier
Showing results 29 to 48 of 82
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| Issue Date | Title | Author(s) |
|---|---|---|
| 6-Sep-2011 | Flexibilidad conformacional de moléculas bioactivas: implicaciones en diseño de fármacos y función de globinas | Forti, Flavio |
| 14-Jan-2022 | From Acid Activation Mechanisms of Proton Conduction to Design of Inhibitors of the M2 Proton Channel of Influenza A Virus | Aledavood, Elnaz; Selmi, Beatrice; Estarellas, Carolina; Masetti, Matteo; Luque Garriga, F. Xavier |
| 2021 | From virtual screening hits targeting a cryptic pocket in BACE-1 to a nontoxic brain permeable multitarget anti-Alzheimer lead with disease-modifying and cognition-enhancing effects | Pont Masanet, Caterina; Ginex, Tiziana; Griñán Ferré, Christian; Scheiner, Matthias; Mattellone, Alexia; Martínez, Noemí; Arce, Elsa M.; Soriano-Fernández, Yolanda; Naldi, Marina; De Simone, Angela; Barenys Espadaler, Marta; Gómez Catalán, Jesús; Pérez, Belén; Sabaté Lagunas, Raimon; Andrisano, Vincenza; Loza, María Isabel; Brea, José; Bartolini, Manuela; Bolognesi, Maria Laura; Decker, Michael; Pallàs i Llibería, Mercè, 1964-; Luque Garriga, F. Xavier; Muñoz-Torrero López-Ibarra, Diego |
| 3-Nov-2018 | Frontiers in Computational Chemistry for Drug Discovery | Luque Garriga, F. Xavier |
| 13-Apr-2018 | Generation and Reactions of an Octacyclic Hindered Pyramidalized Alkene | Camps García, Pelayo; Lozano Mena, David; Barbaraci, C.; Font Bardia, Ma. Mercedes; Luque Garriga, F. Xavier; Estarellas, Carolina |
| 18-Jul-2021 | Holistic approach to anti-knock agents: A high-throughput screening of aniline-like compounds | Viayna Gaza, Antonio; Ghashghaei, Ouldouz; Vílchez Puyo, David; Estarellas, Carolina; López, Manuel; Gómez Catalán, Jesús; Lavilla Grífols, Rodolfo; Delgado, Jesús; Luque Garriga, F. Xavier |
| 2010 | The impact of theoretical chemistry in Biology | Orozco López, Modesto; Luque Garriga, F. Xavier |
| 31-Jan-2013 | Integració recerca/docència en Ciències de la Salut | Anguera Argilaga, María Teresa; Luque Garriga, F. Xavier; Manzano Cuesta, Anna |
| 9-Dec-2019 | Interaction of human hemoglobin and semi-hemoglobins with the Staphylococcus aureus hemophore IsdB: a kinetic and mechanistic insight | Gianquinto, Eleonora; Moscetti, Ilaria; De Bei, Omar; Campanini, Barbara; Marchetti, María Laura; Luque Garriga, F. Xavier; Cannistraro, Salvatore; Ronda, Luca; Bizzarri, Anna Rita; Spyrakis, Francesca; Bettati, Stefano |
| 13-Nov-2015 | Interaction of the N-(3-Methylpyridin-2-yl)amide Derivatives of Flurbiprofen and Ibuprofen with FAAH: Enantiomeric Selectivity and Binding Mode | Karlsson, Jessica; Morgillo, Carmine Marco; Deplano, Alessandro; Smaldone, Giovanni; Pedone, Emilia; Luque Garriga, F. Xavier; Svensson, Mona; Novellino, Ettore; Congiu, Cenzo; Onnis, Valentina; Catalanotti, Bruno; Fowler, Christopher J. |
| 16-Dec-2019 | Interplay between Ionization and Tautomerism in Bioactive β-Enamino Ester-Containing Cyclic Compounds: Study of Annulated 1,2,3,6-Tetrahydroazocine Derivatives | Viayna Gaza, Antonio; Antermite, Salvatore G.; de Candia, Modesto; Altomare, Cosimo D.; Luque Garriga, F. Xavier |
| 15-Apr-2008 | La flexibilitat en els àcids nucleics: Un estudi de dinàmica molecular | Noy Freixa, Agnès |
| 31-Jul-2019 | Ligand Binding Rate Constants in Heme Proteins Using Markov State Models and Molecular Dynamics Simulations | Bringas, Mauro; Lombardi, Leandro E.; Luque Garriga, F. Xavier; Estrín, Darío; Capece, Luciana |
| 25-Feb-2019 | Lipophilicity in drug design: an overview of lipophilicity descriptors in 3D-QSAR studies | Ginex, Tiziana; Vázquez, Javier; Gibert, Enric; Herrero, Enric; Luque Garriga, F. Xavier |
| 15-Oct-2020 | Merging Ligand-Based and Structure-Based Methods in Drug Discovery: An Overview of Combined Virtual Screening Approaches | Vázquez, Javier; López, Manel; Gibert, Enric; Herrero, Enric; Luque Garriga, F. Xavier |
| 25-Jul-2018 | Modelització multiescala del paper de l’entorn en processos de transferència de càrrega i d’energia en biomolècules | Corbella Morató, Marina |
| 12-Dec-2014 | Modelización en diseño de fármacos: Exploración conformacional de ligandos y diseño de inhibidores multipotentes | Juárez Jiménez, Jordi |
| 12-Nov-2019 | Modulating Ligand Dissociation through Methyl Isomerism in Accessory Sites: Binding of Retinol to Cellular Carriers | Estarellas, Carolina; Scaffidi, Salvatore; Saladino, Giorgio; Spyrakis, Francesca; Franzoni, Lorella; Galdeano Cantador, Carlos; Bidon-Chanal Badia, Axel; Gervasio, Francesco Luigi; Luque Garriga, F. Xavier |
| 2-May-2014 | Molecular basis of the selective binding of MDMA enantiomers to the Alpha4Beta2 nicotinic receptor subtype: synthesis, pharmacological evaluation and mechanistic studies | Llabrés Prat, Salomé; García-Ratés, Sara; Cristóbal Lecina, Edgar; Riera i Escalé, Antoni; Borrell, José Ignacio; Camarasa García, Jordi; Pubill Sánchez, David; Luque Garriga, F. Xavier; Escubedo Rafa, Elena |
| 2011 | Molecular simulations of globins: Exploring the relationship between structure, dynamics and function | Forti, Flavio; Boechi, Leonardo; Novo de Oliveira, Ana Luísa; Bikiel, Damian; Arroyo, Pau; Nadra, Alejandro; Capece, Luciana; Bidon-Chanal Badia, Axel; Martí, Marcelo A.; Estrín, Darío; Luque Garriga, F. Xavier |