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Browsing by Author Morreale, Antonio

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RightsIssue DateTitleAuthor(s)
closedAccess2012A reverse combination of structure-based and ligand-based strategies for virtual screeningCortés Cabrera, Álvaro; Gago, Federico; Morreale, Antonio
openAccessMar-2013A structure-based design of new C2- and C13-substituted taxanes: Tubulin binding affinities and extended quantitative structure-activity relationships using comparative binding energy (COMBINE) analysisCoderch, Claire; Tang, Yong; Klett, Javier; Zhang, Shu-En; Ma, Yung-Tao; Shaorong, Wang; Matesanz, Ruth; Pera, Benet; Canales, A.; Jiménez-Barbero, Jesús, et al
closedAccess2012A viral, transporter associated with antigen processing (TAP)-independent, high affinity ligand with alternative interactions endogenously presented by the nonclassical human leukocyte antigen E class I moleculeLorente, Elena; Abia, David; Morreale, Antonio; López, Daniel
openAccess1-Dec-2011An aspartate residue in the external vestibule of GLYT2 (glycine transporter 2) controls cation access and transport couplingPérez‑Siles, Gonzalo; Nuñez, Enrique; Morreale, Antonio; Jiménez, Esperanza; Leo-Macías, Alejandra; Pita, Guillermo; Cherubino, Francesca; Sangaletti, Rachele; Bossi, Elena; Ortíz, Angel R., et al
closedAccess2012An aspartate residue in the external vestibule of GLYT2 (glycine transporter 2) controls cation access and transport couplingPérez‑Siles, Gonzalo; Nuñez, Enrique; Morreale, Antonio; Jimenez, Esperanza; Leo-Macías, Alejandra; Pita, Guillermo; Ortíz, Angel R.; Aragón, Carmen; López Corcuera, Beatriz
closedAccess2012AtlasCBS: A web server to map and explore chemico-biological spaceCortés Cabrera, Álvaro; Morreale, Antonio; Gago, Federico; Abad-Zapatero, Cele
openAccess21-Sep-2014"Bioinformática con Ñ v1.0": a collaborative project of young Spanish scientists to write a complete book about BioinformaticsSebastián, Álvaro; Pascual-García, Alberto; Abascal, Federico; Aguirre, Jacobo, Andrés-León, Eduardo; Bajic, Djordje; Baú, Davide; Bueren-Calabuig, Juan A.; Cortés-Cabrera, Álvaro; Dotu, Iván; Fernández, José M., et al
closedAccess2012Comparative Binding Energy (COMBINE) Analysis Supports a Proposal for the Binding Mode of Epothilones to β-TubulinCoderch, Claire; Klett, Javier; Morreale, Antonio; Fernando Díaz, J.; Gago, Federico
closedAccess16-May-2012Comparative Binding Energy (COMBINE) Analysis Supports a Proposal for the Binding Mode of Epothilones to -Tubulin.Coderch, Claire; Klett, J.; Morreale, Antonio; Díaz, José Fernando; Gago, Federico
closedAccess2013Comparison of ultra-fast 2D and 3D ligand and target descriptors for side effect prediction and network analysis in polypharmacologyCortés Cabrera, Álvaro; Morris, Garret M.; Finn, Paul W.; Morreale, Antonio; Gago, Federico
closedAccess2012CRDOCK: An ultrafast multipurpose protein-ligand docking toolCortés Cabrera, Álvaro; Klett, Javier; Dos Santos, Helena G.; Perona, Almudena; Gil-Redondo, Rubén; Francis, Sandrea M.; Priego, Eva María; Gago, Federico; Morreale, Antonio
closedAccess2012CRDOCK: An ultrafast multipurpose protein-ligand docking toolCortés Cabrera, Álvaro; Klett, Javier; Dos Santos, Helena G.; Perona, Almudena; Gil Redondo, Rubén; Francis, Sandrea M.; Priego, Eva María; Gago, Federico; Morreale, Antonio
closedAccess24-Nov-2009In Memoriam of Angel R. Ortiz (1966-2008)Abia, David; Bastolla, Ugo; Chacón, Pablo; Fábrega Clavería, Carme; Gago, Federico; Morreale, Antonio; Tramontano, Anna
closedAccessDec-2010Insights into nucleotide recognition by cell division protein FtsZ from a mant-GTP competition assay and molecular dynamics.Schaffner-Barbero, Claudia; Gil-Redondo, Rubén; Ruiz-Avila, Laura B.; Huecas, Sonia; Läppchen, Tilman; den Blaauwen, Tanneke; Díaz, José Fernando; Morreale, Antonio; Andreu Morales, José Manuel
closedAccess2013Interactions of bacterial cell division protein FtsZ with C8-substituted guanine nucleotide inhibitors. A combined NMR, biochemical and molecular modeling perspectiveMarcelo, Filipa; Huecas, Sonia; Ruiz-Avila, Laura B.; Cañada Vicinay, Francisco Javier; Perona, Almudena; Poveda, Ana; Martín-Santamaría, Sonsoles; Morreale, Antonio; Jiménez-Barbero, Jesús; Andreu Morales, José Manuel
closedAccess2012MM-ISMSA: An ultrafast and accurate scoring function for protein-protein dockingKlett, Javier; Núñez-Salgado, Alfonso; Dos Santos, Helena G.; Cortés Cabrera, Álvaro; Gil Redondo, Rubén; Abia, David; Gago, Federico; Morreale, Antonio
closedAccess2011Molecular basis of the differential interaction with lithium of glycine transporters GLYT1 and GLYT2Pérez‑Siles, Gonzalo; Morreale, Antonio; Leo-Macías, Alejandra; Pita, Guillermo; Ortíz, Ángel R.; Aragón, Carmen; López-Corcuera, Beatriz
closedAccess2013Novel HLA-B27-restricted epitopes from chlamydia trachomatis generated upon endogenous processing of bacterial proteins suggest a role of molecular mimicry in reactive arthritisÁlvarez-Navarro, Carlos; Cragnolini, Juan José; Dos Santos, Helena G.; Barnea, Eilon; Admon, Arie; Morreale, Antonio; López de Castro, José A.
openAccess3-Nov-2011Rationale for the opposite stereochemistry of the major monoadducts and interstrand crosslinks formed by mitomycin C and its decarbamoylated analogue at CpG steps in DNA and the effect of cytosine modification on reactivityBueren-Calabuig, Juan A.; Negri, Ana; Morreale, Antonio; Gago, Federico
openAccess2012Rationale for the opposite stereochemistry of the major monoadducts and interstrand crosslinks formed by mitomycin C and its decarbamoylated analogue at CpG steps in DNA and the effect of cytosine modification on reactivityBueren-Calabuig, Juan A.; Negri, Ana; Morreale, Antonio; Gago, Federico