Federico Gago Badenas

Artículos

• GAGO BADENAS, Federico; ."Characterization of VldE (Spr1875), a Pneumococcal Two-State l,d-Endopeptidase with a Four-Zinc Cluster in the Active Site". ACS Catalysis. 2024

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• GAGO BADENAS, Federico; ."A distinctive family of L,D-transpeptidases catalyzing L-Ala-mDAP crosslinks in Alpha- and Betaproteobacteria". (ISSN: 2041-1723). Nature Communications. 2024

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• GAGO BADENAS, Federico; ."Flexible structural arrangement and DNA-binding properties of protein p6 from Bacillus subtilis phage phi29.". Nucleic Acids Res.. 2024

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• GAGO BADENAS, Federico; ."Modulation of taxane binding to tubulin curved and straight conformations by systematic 3'N modification provides for improved microtubule binding, persistent cytotoxicity and in vivo potency.". (ISSN: ISSN: 0223-5234). European Journal of Medicinal Chemistry. 2023

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• GAGO BADENAS, Federico; ."Molecular basis of the final step of cell division in Streptococcus pneumoniae". (ISSN: 2211-1247). Cell reports. 2023

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• GAGO BADENAS, Federico; ."Structural insight into pharmacological stabilization of microtubules by taxanes". (ISSN: 2050-084X). elife. 2023

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• PROTA , Andrea; LUCENA-AGELL , Daniel; MA , Yuntao; ESTÉVEZ GALLEGO, Juan; LI , Shuo; BARGSTEN , Katja; JOSA PRADO, Fernando; ALTMANN , K.H.; GAILLARD , Natacha; KAMIMURA , Shinji; MÜHLETHALER , Tobias; GAGO BADENAS, Federico; OLIVA , María Angela; STEINMETZ , Michel O.; FANG , Wei-Shuo; DÍAZ , Juan Fernando; ."Structural insight into the stabilization of microtubules by taxanes". (ISSN: 2050-084X). elife. 2023

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• MARTÍ-MARÍ , Olaia; ABDELNABI , Rana; SCHOLS , Dominique; NEYTS , Johan; CAMARASA RIUS, María José; GAGO BADENAS, Federico; SAN FÉLIX , Ana Rosa; ."Insertion of an amphipathic linker in a tetrapodal tryptophan derivative leads to a novel and highly potent entry inhibitor of enterovirus A71 clinical isolates". (ISSN: 1422-0067). International Journal of Molecular Sciences. 2023

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• GAGO BADENAS, Federico; ."Insertion of an amphipathic linker in a tetrapodal tryptophan derivative leads to a novel and highly potent entry inhibitor of enterovirus A71 clinical isolates". (ISSN: 1661-6596). International Journal of Molecular Sciences. 2023

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• GAGO BADENAS, Federico; ."Computational Approaches to Enzyme Inhibition by Marine Natural Products in the Search for New Drugs". (ISSN: 1660-3397). Marine Drugs. 2023 , vol 21 , num 2 , p. 100 - 129

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• GAGO BADENAS, Federico; ."Computational approaches to enzyme inhibition by marine natural products in the search for new drugs.". (ISSN: 1660-3397). Marine Drugs. 2023

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• OLIVA , María Angela; GAGO BADENAS, Federico; KAMIMURA , Shinji; DÍAZ , Juan Fernando; ."Alternative Approaches to Understand Microtubule Cap Morphology and Function". ACS Omega. 2023

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• ESTÉVEZ GALLEGO, Juan; ALVAREZ BERNAD, Beatriz; PERA , Benet; WULLSCHLEGER , Christoph; RAES , Olivier; MENCHE , Dirk; MARTÍNEZ , Juan Carlos; LUCENA-AGELL , Daniel; PROTA , Andrea; BONATO , Francesca; BARGSTEN , Katja; CORNELUS , Jelle; GIMÉNEZ ABIÁN, Juan Francisco; NORTHCOTE , Peter; STEINMETZ , Michel O.; KAMIMURA , Shinji; ALTMANN , K.H.; PATERSON , I.; GAGO BADENAS, Federico; VAN DER EYCKEN , Johan; DÍAZ , Juan Fernando; OLIVA , María Angela; ."Chemical modulation of microtubule structure through the laulimalide/peloruside site". (ISSN: 0969-2126). Structure. 2023 , vol 31 , num 1 , p. 88 - 99

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• DE LUCIO , Héctor; REVUELTO , Alejandro; CARRILES LINARES, Alejandra Ángela; DE CASTRO , Sonia; GARCÍA GONZÁLEZ, Sonia; GARCÍA SORIANO, Juan Carlos; ALCÓN CALDERÓN, María de las Mercedes; SÁNCHEZ-MURCIA , Pedro A.; HERMOSO , Juan Antonio; GAGO BADENAS, Federico; CAMARASA RIUS, María José; VELÁZQUEZ , Sonsoles; JIMÉNEZ RUIZ, Antonio; ."Identification of 1,2,3-triazolium salt-based inhibitors of Leishmania infantum trypanothione disulfide reductase with enhanced antileishmanial potency in cellulo and increased selectivity". (ISSN: ISSN: 0223-5234). European Journal of Medicinal Chemistry. 2022 , vol 244 , p. 114878 -

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• ALCÓN CALDERÓN, María de las Mercedes; DE LUCIO , Héctor; GARCÍA SORIANO, Juan Carlos; REVUELTO , Alejandro; DE CASTRO , Sonia; LÓPEZ GUTIÉRREZ, Celia; SAN FÉLIX , Ana Rosa; QUESADA , Ernesto; GAGO BADENAS, Federico; CAMARASA RIUS, María José; JIMÉNEZ RUIZ, Antonio; ."Identification of L. infantum trypanothione synthetase inhibitors with leishmanicidal activity from a (non-biased) in-house chemical library". (ISSN: ISSN: 0223-5234). European Journal of Medicinal Chemistry. 2022 , vol 243 , p. 114675 -

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• DE CASTRO , Sonia; STEVAERT , A; MALDONADO , Miguel; DELPAL , Adrien; VALDEPUT , Julie; VAN LOY , Benjamin; EYDOUX , Cecilia; GUILLEMOT , Jean Claude; GAGO BADENAS, Federico; CANARD , Bruno; CAMARASA RIUS, María José; VELÁZQUEZ , Sonsoles; NAESENS , Lieve; ."A Versatile Class of 1,4,4-Trisubstituted Piperidines Block Coronavirus Replication In Vitro.". (ISSN: 1424-8247). Pharmaceuticals. 2022 , vol 15 , num 8 , p. 1021 -

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• MARTÍ-MARÍ , Olaia; MARTÍNEZ-GUALDA , Belén; FERNÁNDEZ-BARAHONA , Irene; MILLS , Alberto; ABDELNABI , Rana; NOPPEN , Sam; NEYTS , Johan; SCHOLS , Dominique; CAMARASA RIUS, María José; HERRANZ RABANAL, Fernando; GAGO BADENAS, Federico; SAN FÉLIX , Ana Rosa; ."Organotropic dendrons with high potency as HIV-1, HIV-2 and EV-A71 cell entry inhibitors.". (ISSN: 0223-5234). European Journal of Medicinal Chemistry. 2022 , vol 237 , p. 114414 -

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• LUCIO ORTEGA, Héctor Elessar de; GARCÍA MARIN, Javier; SÁNCHEZ ALONSO, Patricia; GARCÍA SORIANO, Juan Carlos; TORO LONDOÑO, Miguel; VAQUERO LÓPEZ, Juan José; GAGO BADENAS, Federico; ALAJARÍN FERRÁNDEZ, Luis Ramón; JIMÉNEZ RUIZ, Antonio; ."Pyridazino-pyrrolo-quinoxalinium salts as highly potent and selective leishmanicidal agents targeting trypanothione reductase". (ISSN: 0223-5234). European Journal of Medicinal Chemistry. 2022 , vol 227 , num 113915 , p. 1 - 13 .  .

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• BENAVENTE , Juan Luis; SILIQI , Dritan; INFANTES , Lourdes; LAGARTERA , Laura; MILLS FERNÁNDEZ, Alberto; GAGO BADENAS, Federico; RUIZ-LÓPEZ , Noemí; BOTELLA , Miguel; SÁNCHEZ-BARRENA , María José; ALBERT , Armando; ."The structure of the Arabidopsis synaptotagmin 1 reveals its regulation at membrane contact sites". (ISSN: 2575-1077). Life Science Alliance. 2021 , vol 4 , num 10

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• MILLS , Alberto; GAGO BADENAS, Federico; ."Structural and mechanistic insight into DNA bending by antitumour calicheamicins". (ISSN: 1477-0520). Organic and Biomolecular Chemistry. 2021 , vol 19 , num 30 , p. 6707 - 6717

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• REVUELTO , Alejandro; LOPEZ-MARTIN , Isabel; DE LUCIO , Héctor; GARCÍA SORIANO, Juan Carlos; ZANDA , Nicola; DE CASTRO , Sonia; GAGO BADENAS, Federico; JIMÉNEZ RUIZ, Antonio; VELÁZQUEZ , Sonsoles; CAMARASA RIUS, María José; ."Small Molecule-Peptide Conjugates as Dimerization Inhibitors of Leishmania infantum Trypanothione Disulfide Reductase". (ISSN: 1424-8247). Pharmaceuticals. 2021 , vol 14 , num 7 , p. 689 -

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• MARTÍ-MARÍ , Olaia; MARTINEZ-GUALDA , Belén; DE LA PUENTE SECADES, Sofía; MILLS , Alberto; QUESADA , Ernesto; ABDELNABI , Rana; SUN , Liang; BOONEN , Arnaud; NOPPEN , Sam; NEYTS , Johan; SCHOLS , Dominique; CAMARASA RIUS, María José; GAGO BADENAS, Federico; SAN FÉLIX , Ana Rosa; ."Double Arylation of the Indole Side Chain of Tri- and Tetrapodal Tryptophan Derivatives Renders Highly Potent HIV-1 and EV-A71 Entry Inhibitors". (ISSN: 0022-2623). Journal of Medicinal Chemistry. 2021 , vol 64 , num 14 , p. 10027 - 10046

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• MILLS , Alberto; GAGO BADENAS, Federico; ."On the Need to Tell Apart Fraternal Twins eEF1A1 and eEF1A2, and Their Respective Outfits". (ISSN: 1422-0067). International Journal of Molecular Sciences. 2021 , vol 22 , num 13 , p. 6973 -

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• MILLS , Alberto; GAGO BADENAS, Federico; ."Insight into the sequence-specific elements leading to increased DNA bending and ligase-mediated circularization propensity by antitumor trabectedin". (ISSN: 0920-654X). Journal of Computer-Aided Molecular Design. 2021 , vol 35 , num 6 , p. 707 - 719

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• MILLS , Alberto; GAGO BADENAS, Federico; ."Structural Landscape of the Transition from an ssDNA Dumbbell Plus Its Complementary Hairpin to a dsDNA Microcircle Via a Kissing Loop Intermediate". (ISSN: 1420-3049). Molecules. 2021 , vol 26 , num 10 , p. 3017 -

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• REVUELTO , Alejandro; DE LUCIO , Héctor; GARCÍA SORIANO, Juan Carlos; SÁNCHEZ-MURCIA , Pedro A.; GAGO BADENAS, Federico; JIMÉNEZ RUIZ, Antonio; CAMARASA RIUS, María José; VELÁZQUEZ , Sonsoles; ."Efficient Dimerization Disruption of Leishmania infantum Trypanothione Reductase by Triazole-phenyl-thiazoles". (ISSN: 0022-2623). Journal of Medicinal Chemistry. 2021 , vol 64 , num 9 , p. 6137 - 6160

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• RUIZ-SANTAQUITERIA , Marta; ABDELNABI , Rana; MILLS FERNÁNDEZ, Alberto; MARTÍ-MARÍ , Olaia; NOPPEN , Sam; NEYTS , Johan; SCHOLS , Dominique; GAGO BADENAS, Federico; SAN FÉLIX , Ana Rosa; CAMARASA RIUS, María José; MARTÍN , Nazario; ."Multivalent Tryptophan- and Tyrosine-Containing [60]Fullerene Hexa-Adducts as Dual HIV and Enterovirus A71 Entry Inhibitors". (ISSN: 0947-6539). Chemistry - A European Journal. 2021 , vol 27 , num 41 , p. 10700 - 10710

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• CARRILES LINARES, Alejandra Ángela; MILLS FERNÁNDEZ, Alberto; MUÑOZ ALONSO, María José; DOMÍNGUEZ , Juan Manuel; GUTIÉRREZ , Dolores; HERMOSO , Juan Antonio; GAGO BADENAS, Federico; ."Structural cues for understanding eEF1A2 moonlighting". (ISSN: 1439-4227). Chembiochem : a European journal of chemical biology. 2020 , vol 22 , num 2 , p. 374 - 391

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• PERONA , Almudena; ROS , M. Piedad; MILLS , Alberto; MORREALE , Antonio; GAGO BADENAS, Federico; ."Distinct binding of cetirizine enantiomers to human serum albumin and the human histamine receptor H1". (ISSN: 0920-654X). Journal of Computer-Aided Molecular Design. 2020 .

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• ACOSTA BUENO, Javier; DEL ARCO , Jon; PISABARRO MONTORO, Víctor; GAGO BADENAS, Federico; FERNÁNDEZ-LUCAS , Jesús; ."N-ribosyltransferase from Archaeoglobus veneficus: a novel halotolerant and thermostable biocatalyst for the synthesis of purine ribonucleoside analogues". Frontiers in Bioengineering and Biotechnology. 2020 , vol 8 , num 596

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• MARTINEZ IGLESIAS, Olaia; CASAS PAIS, Alba; CASTOSA , Raquel; DÍAZ DÍAZ, Andrea; ROCA LEMA, Daniel; CONCHA , Anghel; CONCHA , Angel; CORTÉS , Alvaro; GAGO BADENAS, Federico; FIGUEROA , Angélica; ."Hakin-1, a New Specific Small-Molecule Inhibitor for the E3 Ubiquitin-Ligase Hakai, Inhibits Carcinoma Growth and Progression". (ISSN: 2072-6694). Cancers. 2020 , vol 12 , num 5 , p. 3040 -

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• DE CASTRO , Sonia; GINEX , Tiziana; VANDERLINDEN , E; LAPORTE , M; STEVAERT , A; CUMELLA , J.M.; GAGO BADENAS, Federico; CAMARASA RIUS, María José; LUQUE , F. Javier; NAESENS , L.; VELÁZQUEZ , Sonsoles; ."N-benzyl 4,4-disubstituted piperidines as a potent class of influenza H1N1 virus inhibitors showing a novel mechanism of hemagglutinin fusion peptide interaction". (ISSN: 0223-5234). European Journal of Medicinal Chemistry. 2020 , vol 194 , p. 112223 -

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• GIGANTE , Alba; SIJBESMA , E.; SÁNCHEZ-MURCIA , Pedro A.; HU , X.; BIER , D.; BÄCKER , S.; KNAUER , S.; GAGO BADENAS, Federico; OTTMANN , C.; SCHMUCK , C.; ."A supramolecular stabilizer of the 3-3zeta/ERalfa protein-protein interaction with a synergistic mode of action.". (ISSN: 0570-0833). Angewandte Chemie - International Edition in English. 2020 , vol 59 , num 13 , p. 5284 - 5287

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• SÁNCHEZ-BARRENA , María José; CHAVES-SANJUAN , Antonio; RADDATZ , Natalia; MENDOZA , Imelda; CORTÉS CABRERA, Alvaro; GAGO BADENAS, Federico; GONZÁLEZ-RUBIO , Juana María; BENAVENTE , Juan Luis; QUINTERO , Francisco J.; PARDO , José M.; ALBERT , Armando; ."Recognition and activation of the plant AKT1 potassium channel by the kinase CIPK23". (ISSN: 0032-0889). Plant Physiology. 2020 , vol 182 , num 4 , p. 2143 - 2153

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• HERRERA-AROZAMENA , Clara; ESTRADA-VALENCIA , Martín; PÉREZ , Concepción; LAGARTERA , Laura; MORALES-GARCÍA , José A.; PÉREZ-CASTILLO , Ana; FRANCO-GONZÁLEZ , Juan Felipe; MICHALSKA , Patrycja; DUARTE , Pablo; LEÓN , Rafael; LÓPEZ , Manuela G.; MILLS , Alberto; GAGO BADENAS, Federico; GARCÍA-YAGÜE , Ángel Juan; FERNÁNDEZ-GINÉS , Raquel; CUADRADO , Antonio; ."Tuning melatonin receptor subtype selectivity in oxadiazolone-based analogues: Discovery of QR2 ligands and NRF2 activators with neurogenic properties". (ISSN: 0223-5234). European Journal of Medicinal Chemistry. 2020 , vol 190 , p. 112090 -

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• SÁNCHEZ-MURCIA , Pedro A.; DE CASTRO , Sonia; GARCÍA-APARICIO , Carlos; JIMÉNEZ , M. Angeles; CORONA , Angela; TRAMONTANO , Enzo; SLUIS-CREMER , Nicolas; MENÉNDEZ-ARIAS , Luis; VELÁZQUEZ , Sonsoles; GAGO BADENAS, Federico; CAMARASA RIUS, María José; ."Peptides mimicking the beta7/beta8 loop of HIV-1 reverse transcriptase p51 as "hotspot-targeted" dimerization inhibitors". (ISSN: 1948-5875). ACS Medicinal Chemistry Letters. 2020 , vol 11 , num 5 , p. 811 - 817

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• MARTÍNEZ-GUALDA , Belén; SUN , Liang; MARTÍ-MARÍ , Olaia; NOPPEN , Sam; ABDELNABI , Rana; BATOR , Carol M; QUESADA , Ernesto; DELANG , Leen; MIRABELLI , Carmen; LEE , Hyunwook; SCHOLS , Dominique; NEYTS , Johan; HAFENSTEIN , Susan; CAMARASA RIUS, María José; GAGO BADENAS, Federico; SAN FÉLIX , Ana Rosa; ."Scaffold simplification strategy leads to a novel generation of dual human immunodeficiency virus and enterovirus-A71 entry inhibitors". (ISSN: 0022-2623). Journal of Medicinal Chemistry. 2020 , vol 63 , num 1 , p. 349 - 368

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• LOSADA , Alejandro; BERLANGA , Juan José; MOLINA-GUIJARRO , José Manuel; JIMÉNEZ RUIZ, Antonio; GAGO BADENAS, Federico; AVILÉS MARÍN, Pablo Manuel; DE HARO , César; MARTÍNEZ LEAL, Juan Fernando; ."Generation of endoplasmic reticulum stress and inhibition of autophagy by plitidepsin induces proteotoxic apoptosis in cancer cells". (ISSN: 0006-2952). Biochemical Pharmacology. 2020 , vol 172 , p. 1137 -

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• HORGA , Alejandro; WOODWARD , Catherine E; MILLS , Alberto; PAREÉS , Isabel; HARGREAVES , Iain P; BROWN , Ruth M; BUGIARDINI , Enrico; BROOKS , Tony; MANOLE , Andreea; REMZOVA , Elena; RAHMAN , Shamima; REILLY , Mary M; HOULDEN , Henry; SWEENEY , Mary G; BROWN , Garry K; POLKE , James M; GAGO BADENAS, Federico; PARTON , Matthew J; PITCEATHLY , Robert D S; HANNA , Michael G; ."Differential phenotypic expression of a novel PDHA1 mutation in a female monozygotic twin pair". (ISSN: 0340-6717). Human Genetics. 2019 , vol 138 , num 11-12 , p. 1313 - 1322

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• DEL ARCO , Jon; PERONA , Almudena; GONZÁLEZ , Leticia; FERNÁNDEZ-LUCAS , Jesús; GAGO BADENAS, Federico; SÁNCHEZ-MURCIA , Pedro A.; ."Reaction mechanism of nucleoside 2'-deoxyribosyltransferases: Free-energy landscape supports an oxocarbenium ion as the reaction intermediate". (ISSN: 1477-0520). Organic and Biomolecular Chemistry. 2019 , vol 17 , num 34

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• CRUCIANI , Gabriele; MARTIN , Yvonne; VINTER , Andy; LEWIS , Richard; GAGO BADENAS, Federico; STOUCH , Terry; ."How computational chemistry develops: A tribute to Peter Goodford". (ISSN: 0920-654X). Journal of Computer-Aided Molecular Design. 2019 , vol 33 , num 8 , p. 699 - 703

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• DEL ARCO , Jon; MILLS , Alberto; GAGO BADENAS, Federico; FERNÁNDEZ-LUCAS , Jesús; ."Structure-guided tuning of a selectivity switch towards ribonucleosides in Trypanosoma brucei purine nucleoside 2'-deoxyribosyltransferase". (ISSN: 1439-4227). Chembiochem : a European journal of chemical biology. 2019

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• DE CASTRO , Sonia; FERRER-ORTA , Cristina; FERNÁNDEZ-CURESES , Gloria; MILLS , Alberto; GAGO BADENAS, Federico; VERDAGUER , Nuria; CAMARASA RIUS, María José; ."(F)uridylylated peptides linked to VPg1 of foot-and-mouth disease virus (FMDV): design, synthesis and X-ray crystallography of the complexes with FMDV RNA-dependent RNA polymerase". (ISSN: 1420-3049). Molecules. 2019 , vol 24 , num 13 , p. E2360 -

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• ZHAO , Yu; WANG , Tian-En; MILLS , Alberto; GAGO BADENAS, Federico; FANG , Wei-Shuo; ."Synthesis and cytotoxicity of 7,9-O-linked macrocylic C-seco taxoids". (ISSN: 1420-3049). Molecules. 2019 , vol 24 , num 11 , p. E2161 -

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• SÁNCHEZ-MURCIA , Pedro A.; MILLS , Alberto; CORTÉS CABRERA, Alvaro; GAGO BADENAS, Federico; ."Unravelling the covalent binding of zampanolide and taccalonolide AJ to a minimalist representation of a human microtubule". (ISSN: 0920-654X). Journal of Computer-Aided Molecular Design. 2019

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• SUN , Liang; LEYSSEN , Pieter; GAGO BADENAS, Federico; SAN FÉLIX , Ana Rosa; HAFENSTEIN , Susan; MIRABELLI , Carmen; NEYTS , Johan; LEE , Hyunwook; THIBAUT , Hendrik Jan; LANKO , Kristina; RIVERO-BUCETA , Eva; BATOR , Carol; MARTINEZ-GUALDA , Belén; DALLMEIER , Kai; DELANG , Leen; ."Viral engagement with host receptors blocked by a novel class of tryptophand endrimers that targets the 5-fold-axis of the enterovirus-A71 capsid". (ISSN: 1553-7366). PLoS Pathogens. 2019 , vol 15 , num 5 , p. e1007760 -

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• BERNARDO-GARCÍA , Noelia; SÁNCHEZ-MURCIA , Pedro A.; ESPAILLAT , Akbar; MARTÍNEZ-CABALLERO , Siseth; CAVA , Felipe; HERMOSO , Juan Antonio; GAGO BADENAS, Federico; ."Cold-induced aldimine bond cleavage by Tris in Bacillus subtilis alanine racemase". (ISSN: 1477-0520). Organic and Biomolecular Chemistry. 2019 , vol 17 , num 17 , p. 4350 - 4358

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• REVUELTO , Alejandro; RUIZ-SANTAQUITERIA , Marta; LUCIO ORTEGA, Héctor Elessar de; GAMO , Ana; CARRILES , Alejandra; GUTIERREZ , Kilian Jesús; SÁNCHEZ MURCIA, Pedro Alejandro; HERMOSO , Juan A.; GAGO BADENAS, Federico; CAMARASA , María José; JIMÉNEZ RUIZ, Antonio; VELÁZQUEZ , Sonsoles; ."Pyrrolopyrimidine vs Imidazole-Phenyl-Thiazole Scaffolds in Nonpeptidic Dimerization Inhibitors of Leishmania infantum Trypanothione Reductase ". ACS Infectious Diseases. 2019 , vol 5 , num 6 , p. 873 - 891 .  .

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• BRAVO , Ana; LUCIO ORTEGA, Héctor Elessar de; SÁNCHEZ MURCIA, Pedro; JIMÉNEZ RUIZ, Antonio; PETRONE , Paula M.; GAGO BADENAS, Federico; CORTÉS CABRERA, Alvaro; ."Identification of NEK3 and MOK as novel targets for lithium". (ISSN: 1747-0277). Chemical Biology and Drug Design. 2019 .

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• PÉREZ , Elena; SÁNCHEZ-MURCIA , Pedro A.; JORDAAN , Justin; BLANCO , Mª Dolores; MANCHEÑO , José Miguel; GAGO BADENAS, Federico; FERNÁNDEZ-LUCAS , Jesús; ."Enzymatic synthesis of therapeutic nucleosides using a highly versatile purine nucleoside 2'-deoxyribosyltransferase from Trypanosoma brucei". (ISSN: 1867 -3880). ChemCatChem. 2018 , vol 10 , num 4 , p. 4406 - 4416

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• KRAIT , Sulaiman; SALGADO SERRANO, Antonio; CHANKVETADZE , Bezhan; GAGO BADENAS, Federico; SCRIBA , Gerhard K.E.; ."Investigation of the complexation between cyclodextrins and medetomidine enantiomers by capillary electrophoresis, NMR spectroscopy and molecular modeling". (ISSN: 00219673). Journal of Chromatography A. 2018 , vol 1567 , p. 198 - 210

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• DEL ARCO , Jon; SÁNCHEZ-MURCIA , Pedro A.; MANCHEÑO , José Miguel; GAGO BADENAS, Federico; FERNÁNDEZ-LUCAS , Jesús; ."Characterization of an atypical, thermostable, organic solvent- and acid-tolerant nucleoside 2'-deoxyribosyltransferase from Chroococcidiopsis thermalis PCC 7203". (ISSN: 0175-7598). Applied Microbiology and Biotechnology. 2018 , vol 102 , num 16 , p. 6947 - 6957

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• MA , Yun-Tao; YANG , Yanting; CAI , Pei; SUN , De-Yang; SÁNCHEZ-MURCIA , Pedro A.; ZHANG , Xiao-Ying; JIA , Wen-Qiang; LEI , Lei; GUO , Mengqi; WANG , Hongbo; GAGO BADENAS, Federico; FANG , Wei-Shuo; ."A Series of Enthalpically Optimized Docetaxel Analogues ExhibitingEnhanced Antitumor Activity and Water Solubility". (ISSN: 0163-3864). Journal of Natural Products. 2018

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• TORRES-SALAS , Pamela; BERNAL , Vicente; SÁNCHEZ-MURCIA , Pedro A.; GAGO BADENAS, Federico; MORREALE DE LEÓN, Antonio Jesús; GONZÁLEZ-BARROSO , María del Mar; ."Engineering Erg10 thiolase from Saccharomyces cerevisiae as a synthetic toolkit for the production of branched-chain alcohols". (ISSN: 0006-2960). Biochemistry. 2018

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• DE LUCIO , Héctor; GAMO , Ana María; RUIZ-SANTAQUITERIA , Marta; DE CASTRO , Sonia; SÁNCHEZ-MURCIA , Pedro A.; TORO LONDOÑO, Miguel Ángel; GUTIÉRREZ VIÑAS, Kilian Jesús; GAGO BADENAS, Federico; JIMÉNEZ RUIZ, Antonio; CAMARASA RIUS, María José; VELÁZQUEZ , Sonsoles; ."Improved proteolytic stability and potent activity against Leishmania infantum trypanothione reductase of alfa/beta peptide foldamers conjugated to cell-penetrating peptides". (ISSN: 0223-5234). European Journal of Medicinal Chemistry. 2017 , vol 140 , p. 615 - 623

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• SALGADO SERRANO, Antonio; TATUNASHVILI , Elene; GOGOLASHVILI , Ann; CHANKVETADZE , Bezhan; GAGO BADENAS, Federico; ."Structural rationale for the chiral separation and migration order reversal of clenpenterol enantiomers in capillary electrophoresis using two different beta-cyclodextrins". (ISSN: 1463-9076). Physical Chemistry Chemical Physics. 2017 , vol 19 , num 41 , p. 27935 - 27939

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• SÁNCHEZ-MURCIA , Pedro A.; GAGO BADENAS, Federico; CORTÉS CABRERA, Alvaro; ."Structural rationale for the cross-resistance of tumor cells bearing the A399V variant of elongation factor eEF1A1 to the structurally unrelated didemnin B, ternatin, nannocystin A and ansatrienin B". (ISSN: 0920-654X). Journal of Computer-Aided Molecular Design. 2017 , vol 31 , num 10 , p. 915 - 928

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• CORTÉS CABRERA, Álvaro; SÁNCHEZ-MURCIA , Pedro A.; GAGO BADENAS, Federico; ."Making sense of the past: hyperstability of ancestral thioredoxins explained by free energy simulations.". (ISSN: 1463-9076). Physical Chemistry Chemical Physics. 2017 , vol 19 , p. 23239 - 23246

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• CRESPO , Noé; SÁNCHEZ-MURCIA , Pedro A.; GAGO BADENAS, Federico; CEJUDO-SANCHES , Janaina; GALMES , Miguel A.; FERNÁNDEZ-LUCAS , Jesús; MANCHEÑO , José Miguel; ."2′-Deoxyribosyltransferase from Leishmania mexicana, an efficient biocatalyst for one-pot, one-step synthesis of nucleosides from poorly soluble purine bases". (ISSN: 0175-7598). Applied Microbiology and Biotechnology. 2017 , vol 101 , p. 7187 - 7200

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• OLIVA CORREIA, Cristina; SÁNCHEZ-MURCIA , Pedro A.; RICO VIDAL, Eva; BRAVO GARCÍA, Ana; MENÉNDEZ , Margarita; GAGO BADENAS, Federico; JIMÉNEZ RUIZ, Antonio; ."Structure-based domain assignment in Leishmania infantum EndoG: characterization of a pH-dependent regulatory switch and a C-terminal extension that largely dictates DNA substrate preferences.". (ISSN: 0305-1048). Nucleic Acids Research. 2017 , vol 45 , num 15 , p. 9030 - 9045

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• TRIGILI , Chiara; BARASOAIN , Isabel; SÁNCHEZ-MURCIA , Pedro A.; BARGSTEN , Katja; REDONDO-HORCAJO , Mariano; NOGALES , Aurora; GARDNER , Nicola M.; MEYER , Arndt; NAYLOR , Guy J.; GÓMEZ-RUBIO , Elena; GAGO BADENAS, Federico; STEINMETZ , Michel O.; PATERSON , I.; PORTA , Andrea E.; DÍAZ , Juan Fernando; ."Structural determinants of the dictyostatin chemotype for tubulin binding affinity and antitumor activity against taxane- and epothilone-resistant cancer cells". ACS Omega. 2016 , vol 1 , p. 1192 - 1204

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• GUTIÉRREZ-FERNÁNDEZ , Javier; SALEH , Malek; ALCORLO , Martín; GÓMEZ M. , Alejandro; PANTOJA-UCEDA , David; TREVIÑO , Miguel A.; VOß , Franziska; ABDULLAH , Mohammed R.; GALÁN-BARTUAL , Sergio; SEINEN , Jolien; SÁNCHEZ-MURCIA , Pedro A.; GAGO BADENAS, Federico; BRUIX , Marta; HAMMERSCHMIDT , Sven; HERMOSO , Juan Antonio; ."Modular Architecture and Unique Teichoic Acid Recognition Features of Choline-Binding Protein L (CbpL) Contributing to Pneumococcal Pathogenesis ". (ISSN: 2045-2322). Scientific Reports. 2016

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• SÁNCHEZ-MURCIA , Pedro A.; BUEREN CALABUIG, Juan Antonio; CAMACHO-ARTACHO , Marta; CORTÉS CABRERA, Alvaro; GAGO BADENAS, Federico; ."Stepwise simulation of 3,5-dihydro-5-methylidene-4H-imidazol-4-one (MIO) biogenesis in histidine ammonia-lyase". (ISSN: 0006-2960). Biochemistry. 2016 , vol 55 , num 41 , p. 5854 - 5864

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• LOSADA , Alejandro; MUÑOZ-ALONSO , M. José; GARCÍA , Carolina; SÁNCHEZ-MURCIA , Pedro A.; MARTÍNEZ LEAL, Juan Fernando; DOMÍNGUEZ , Juan Manuel; LILLO , M. Pilar; GAGO BADENAS, Federico; GALMARINI , Carlos M.; ."Translation elongation factor eEF1A2 is a novel anticancer target for the marine natural product plitidepsin". Scientific Reports. 2016 , vol 6 , p. 35100 -

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• FILACE , Fabiana; SÁNCHEZ MURCIA, Pedro Alejandro; SUCUNZA SÁENZ, David; PÉREZ REDONDO, Adrián; GAGO BADENAS, Federico; ÁLVAREZ-BUILLA GÓMEZ, Julio; BURGOS GARCÍA, Carolina; ."Silyl Assistance in the Intramolecular Addition of Pyridyl Radicals onto Pyridines and Quinolines". (ISSN: 1434-193X). European Journal of Organic Chemistry. 2016 , p. 1891 - 1896

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• SHAORONG , Wang; YANG , Chun-Gang; SÁNCHEZ-MURCIA , Pedro A.; SNYDER , James P.; YANB , Ning; SÁEZ-CALVO , Gonzalo; DÍAZ , Juan Fernando; GAGO BADENAS, Federico; FANG , Weishuo; ."Restoration of Microtubule Interaction and Cytotoxicity in D-seco Taxanes upon Incorporation of 20-Hydroxymethyl-4-allyloxy Groups". (ISSN: 1523-7060). Organic Letters. 2015

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• SHAORONG , Wang; SÁNCHEZ-MURCIA , Pedro A.; GAGO BADENAS, Federico; FANG , Weishuo; ."A novel C,D-spirodioxene taxoid synthesized through an unexpected Pd-mediated ring cyclization". (ISSN: 1477-0520). Organic and Biomolecular Chemistry. 2015

  ---

• DÍEZ-DACAL , Beatriz; SÁNCHEZ-GÓMEZ , F.J.; SÁNCHEZ MURCIA, Pedro Alejandro; MILACKOVA , Ivana; ZIMMERMAN , Tahl; BALLEKOVA , Jana; GARCÍA-MARTÍN , Elena; G. AGÚNDEZ, José A.; GHARBI , Severine; GAGO BADENAS, Federico; STEFEK , Milan; PÉREZ-SALA , Dolores; ."Molecular Interactions and Implications of Aldose Reductase Inhibition by PGA1 and Clinically Used Prostaglandins". (ISSN: 0026-895X). Molecular Pharmacology. 2015

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• DE CASTRO , Sonia; FERNÁNDEZ-CURESES , Gloria; ANDREI , Graciela; SNOECK , Robert; SÁNCHEZ MURCIA, Pedro Alejandro; KORBA , Brent; GAGO BADENAS, Federico; BALZARINI , Jan; CAMARASA RIUS, María José; ."Conservation of antiviral activity and improved selectivity in PMEO-DAPym upon pyrimidine to triazine scaffold hopping". (ISSN: 0166-3542). Antiviral Research. 2015 , vol 122 , p. 64 - 68

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• BENAVENTE , Rocío; ESTEBAN TORRES, María; KOHRING , Gert-Wieland; CORTÉS CABRERA, Álvaro; SÁNCHEZ-MURCIA , Pedro A.; GAGO BADENAS, Federico; MANCHEÑO , José Miguel; ACEBRÓN , Iván; DE LAS RIVAS , Blanca; MUÑOZ , Rosario; MANCHEÑO , José M; ."Enantioselective oxidation of galactitol-1-phosphate by galactitol-1-phosphate 5-dehydrogenase from Escherichia coli". (ISSN: 0907-4449). Acta Crystallographica Section D: Biological Crystallography. 2015 , vol D71 , p. 1540 - 1554

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• SÁNCHEZ-MURCIA , Pedro A.; RUIZ%U2010SANTAQUITERIA , Marta; TORO LONDOÑO, Miguel Ángel; DE LUCIO , Héctor; JIMÉNEZ , M. Angeles; GAGO BADENAS, Federico; JIMÉNEZ RUIZ, Antonio; CAMARASA RIUS, María José; VELÁZQUEZ , Sonsoles; ."Comparison of hydrocarbon- and lactam-bridged cyclic peptides as dimerization inhibitors of Leishmania infantum trypanothione reductase". (ISSN: 2046-2069). RSC Advances. 2015 , vol 5 , p. 55784 - 55794

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• CORTÉS CABRERA, Alvaro; GAGO BADENAS, Federico; MORREALE DE LEÓN, Antonio Jesús; ."A Computational Fragment-Based De Novo Design Protocol Guided by Ligand Efficiency Indices (LEI)". (ISSN: 1064-3745). Methods in molecular biology (Clifton, N.J.). 2015

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• GHERBOVET , Olga; SÁNCHEZ-MURCIA , Pedro A.; GAGO BADENAS, Federico; ROUSSI , Fanny; ."Synthesis and evaluation of hybrid molecules targeting the vinca domain of tubulin". (ISSN: 1477-0520). Organic and Biomolecular Chemistry. 2015 , vol 13 , num 10 , p. 3144 - 3154

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• BERNARDO-GARCÍA , Noelia; SÁNCHEZ-MURCIA , Pedro A.; GAGO BADENAS, Federico; HERMOSO , Juan Antonio; ."Structural bioinformatics in broad-spectrum racemases: a new path in antimicrobial research". (ISSN: 1385-2728). Current Organic Chemistry. 2015

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• GHERBOVET , Olga; CODERCH BOUÉ, Claire; GARCÍA ALVAREZ, M. Concepción; BIGNON , Jérôme; THORET , Sylviane; GUÉRITTE , Françoise; GAGO BADENAS, Federico; ROUSSI , Fanny; ."One-Pot Synthesis of Vinca Alkaloids-Phomopsin Hybrids". (ISSN: 0022-2623). Journal of Medicinal Chemistry. 2014 , vol 57 , num 12 , p. 5470 - 5476

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• BURGOS GARCÍA, Carolina; VAQUERO LÓPEZ, Juan José; CORTÉS CABRERA, Alvaro; ÁLVAREZ-BUILLA GÓMEZ, Julio; GAGO BADENAS, Federico; SEGARRA , Víctor; ."Microwave-assisted synthesis of potent PDE7 inhibitors containing a novel thienopyrimidin-4-amine scaffold". (ISSN: 1477-0520). Organic and Biomolecular Chemistry. 2014 , vol 12 , p. 4233 - 4242

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• JOHAN VANDE VOORDE , Johan Vande; LIEKENS , Sandra; GAGO BADENAS, Federico; BALZARINI , Jan; ."The Pyrimidine Nucleoside Phosphorylase of Mycoplasma hyorhinis and How It May Affect Nucleoside-Based Therapy". (ISSN: 1525-7770). Nucleosides, Nucleotides and Nucleic Acids. 2014 , vol 33 , num 4-6 , p. 394 - 402

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• ALVAREZ , Yanaisis; MANCHEÑO , José Miguel; ESTEBAN TORRES, María; CORTÉS CABRERA, Alvaro; GAGO BADENAS, Federico; ACEBRÓN , Iván; BENAVENTE , Rocío; MARDO , Karin; DE LAS RIVAS , Blanca; MUÑOZ , Rosario; ."Esterase LpEst1 from Lactobacillus plantarum: a novel and peculiar member of the alfa/beta hydrolase superfamily of enzymes". (ISSN: 1932-6203). PLoS ONE. 2014 , vol 9 , num 3 , p. 9225 -

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• KLETT , Javier; CORTÉS CABRERA, Alvaro; GIL-REDONDO , Rubén; GAGO BADENAS, Federico; MORREALE , Antonio; ."ALFA: Automatic Ligand Flexibility Assignment". (ISSN: 1549-9596). Journal of Chemical Information and Modeling. 2014 , vol 54 , num 1 , p. 314 - 323

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• CODERCH BOUÉ, Claire; PEÓN , Antonio; GAGO BADENAS, Federico; GONZÁLEZ-BELLO , Concepción; ."Mechanistic insight into the reaction catalysed by bacterial type II dehydroquinases". (ISSN: 0264-6021). Biochemical Journal. 2014 , vol 3 , num 458 , p. 547 - 557

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• CANALES MAYORDOMO, Angeles; NIETO , L.; RODRÍGUEZ-SALARICHS , J.; SÁNCHEZ-MURCIA , Pedro A.; CODERCH BOUE, Claire; CORTÉS CABRERA, Alvaro; PATERSON , I.; CARLOMAGNO , Teresa; GAGO BADENAS, Federico; ANDRÉU , J.M.; ALTMANN , K.H.; JIMÉNEZ-BARBERO , Jesús; DÍAZ , Juan Fernando; ."The molecular recognition of epothilones by microtubules and tubulin dimers revealed by biochemical and NMR approaches". (ISSN: 1554-8929). ACS chemical biology. 2014

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• RICO , E.; OLIVA CORREIA, Cristina; GUTIERREZ , K.J.; ALZATE , J.F.; GENES , C.M.; MORENO-MATEOS , D.; CASANOVA , E.; GIGANTE , A.; PEREZ-PEREZ , M.J.; CAMARASA , M.J.; GAGO BADENAS, Federico; JIMÉNEZ RUIZ, Antonio; ."Leishmania infantum EndoG is an endo/exo-nuclease essential for parasite survival". (ISSN: 1932-6203). PLoS ONE. 2014

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• GAGO BADENAS, Federico; PARAYIL , A.; ."New horizons in pharmaceutical biotechnology by melding biology and engineering". (ISSN: 0958-1669). Current Opinion in Biotechnology. 2013 , vol 24 , num 6 , p. 1069 - 1071

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• MARTÍNEZ , S.; GALMARINI , Carlos M.; ARACIL , Miguel; GAGO BADENAS, Federico; ALBELLA , B.; BUEREN , Juan Antonio; ."Inhibitory effects of marine-derived DNA-binding antitumour tetrahydroisoquinolines on the Fanconi anemia pathway". (ISSN: 0007-1188). British Journal of Pharmacology. 2013 , vol 170 , num 4 , p. 871 - 882

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• CORTÉS CABRERA, Alvaro; MORRIS , Garrett; FINN , Paul; MORREALE DE LEÓN, Antonio Jesús; GAGO BADENAS, Federico; ."Comparison of Ligand and Target Descriptors for Side Effect Prediction and Network Analysis in Polypharmacology". (ISSN: 0007-1188). British Journal of Pharmacology. 2013 , vol 3 , num 170 , p. 557 - 567

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• GHERBOVET , Olga; CODERCH BOUÉ, Claire; GARCIA ALVAREZ, Maria Concepcion; BIGNON , Jérôme; THORET , Sylviane; MARTIN , Marie-Thérèse; GUÉRITTE , Françoise; GAGO BADENAS, Federico; ROUSSI , Fanny; ."Synthesis and Biological Evaluation of a New Series of Highly Functionalized 7'-Homo-Anhydrovinblastine Derivatives". (ISSN: 0022-2623). Journal of Medicinal Chemistry. 2013 , vol 56 , num 15 , p. 6088 - 6100

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• TORO LONDOÑO, Miguel Ángel; SÁNCHEZ-MURCIA , Pedro A.; MORENO MATEOS, David; RUIZ-SANTAQUITERIA , Marta; ALZATE RESTREPO, Juan Fernando; NEGRI MARTÍNEZ, Ana; CAMARASA RIUS, María José; GAGO BADENAS, Federico; VELÁZQUEZ , Sonsoles; JIMÉNEZ RUIZ, Antonio; SÁNCHEZ MURCIA, Pedro Alejandro; ."Probing the Dimerization Interface of Leishmania infantum Trypanothione Reductase with Site-Directed Mutagenesis and Short Peptides". (ISSN: 1439-4227). Chembiochem : a European journal of chemical biology. 2013 , num 4(10) , p. 1212 - 1217 .

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• MENÉNDEZ-ARIAS , Luis; GAGO BADENAS, Federico; ."Antiviral agents: structural basis of action and rational design". (ISSN: 0306-0225). Sub-Cellular Biochemistry. 2013 , num 68 , p. 599 - 630

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• CASANOVA MALPICA, Elena; MORENO MATEOS, David; GIGANTE MARTÍNEZ, Alba; RICO VIDAL, Eva; GENES ROBLES, Carlos Mario; OLIVA CORREIA, Cristina; CAMARASA RIUS, María José; GAGO BADENAS, Federico; JIMÉNEZ RUIZ, Antonio; PÉREZ PÉREZ, Mª Jesús; ."5'-Trityl-Substituted Thymidine Derivatives as a Novel Class of Antileishmanial Agents: Leishmania infantum EndoG as a Potential Target". (ISSN: 1860-7179). ChemMedChem. 2013 , num 8(7) , p. 1161 - 1174

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• CODERCH BOUÉ, Claire; TANG , Yong; KLETT , Javier; ZHANG , Shu-En; MA , Yun-Tao; SHAORONG , Wang; MATESANZ , Ruth; PERA , Benet; CANALES MAYORDOMO, Angeles; JIMÉNEZ-BARBERO , Jesús; MORREALE , Antonio; DIAZ PEREIRA, José Fernando; FANG , Weishuo; GAGO BADENAS, Federico; ."A structure-based design of new C2- and C13-substituted taxanes: tubulin binding affinities and quantitative structure-activity relationships using Comparative Binding Energy (COMBINE) analysis". (ISSN: 1477-0520). Organic and Biomolecular Chemistry. 2013 , num 11 (18) , p. 3046 - 3056

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• PEÓN , Antonio; CODERCH BOUÉ, Claire; GAGO BADENAS, Federico; GONZÁLEZ-BELLO , Concepción; ."Comparative Binding Energy (COMBINE) Analysis for Understanding the Binding Determinants of Type II Dehydroquinase Inhibitors". (ISSN: 1860-7179). ChemMedChem. 2013 , vol 8(5) , p. 740 - 747

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• CORTÉS CABRERA, Álvaro; KLETT , Javier; G. DOS SANTOS, Helena; PERONA , Almudena; GIL-REDONDO , Rubén; FRANCIS , Sandrea M.; PRIEGO , Eva M.; GAGO BADENAS, Federico; MORREALE DE LEÓN, Antonio Jesús; ."CRDOCK: An Ultrafast Multipurpose Protein−Ligand Docking Tool". (ISSN: 1549-9596). Journal of Chemical Information and Modeling. 2012 , vol 52 , p. 2300 - 2309

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• KLETT , Javier; NÚÑEZ-SALGADO , Alfonso; G. DOS SANTOS, Helena; CORTÉS CABRERA, Alvaro; PERONA , Almudena; GIL-REDONDO , Rubén; ABIA , David; GAGO BADENAS, Federico; MORREALE DE LEÓN, Antonio Jesús; ."MM-ISMSA: An Ultrafast and Accurate Scoring Function for Protein&-Protein Docking". (ISSN: 1549-9618). Journal of Chemical Theory and Computation. 2012 , vol 8 (9) , p. 3395 - 3408

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• KLETT ARROYO, Javier; NÚÑEZ SALGADO, Alfonso Francisco; GOMEZ DOS SANTOS, Helena; CORTÉS CABRERA, Alvaro; PERONA REQUENA, Almudena; GIL REDONDO, Rubén; ABIA , David; GAGO BADENAS, Federico; MORREALE DE LEÓN, Antonio Jesús; ."MM-ISMSA: an ultra-fast and accurate scoring function for protein-protein docking". (ISSN: 1549-9618). Journal of Chemical Theory and Computation. 2012 , vol 9 , num 8 , p. 3395 - 3408

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• CORTÉS CABRERA, Alvaro; GAGO BADENAS, Federico; MORREALE DE LEÓN, Antonio Jesús; ABAD-ZAPATERO , Cele; ."AtlasCBS: A web server to map and explore chemico-biological space". (ISSN: 0920-654X). Journal of Computer-Aided Molecular Design. 2012 , num 26(9) , p. 995 - 1003

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• BALZARINI , Jan; GAGO BADENAS, Federico; KULIK , Wim; VAN KUILENBURG , Andre B.P.; KARLSSON , Anna; PETERSON , Matt A.; ROBINS , Morris J.; ."INTRODUCTION OF A FLUORINE ATOM AT C3 OF 3-DEAZAURIDINE SHIFTS ITS ANTIMETABOLIC ACTIVITY FROM INHIBITION OF CTP SYNTHETASE TO INHIBITION OF OROTIDYLATE DECARBOXYLASE, AN EARLY EVENT IN THE DE NOVO PYRIMIDINE NUCLEOTIDE BIOSYNTHESIS PATHWAY". (ISSN: 0021-9258). Journal of Biological Chemistry. 2012

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• CODERCH BOUÉ, Claire; KLETT , Javier; MORREALE DE LEÓN, Antonio Jesús; DÍAZ , Juan Fernando; GAGO BADENAS, Federico; ."Comparative Binding Energy (COMBINE) Analysis Supports a Proposal for the Binding Mode of Epothilones to beta-Tubulin". (ISSN: 1860-7179). ChemMedChem. 2012 , vol 7(5) , p. 836 - 844

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• PRIEGO , Eva M.; KARLSSON , Anna; GAGO BADENAS, Federico; CAMARASA RIUS, María José; BALZARINI , Jan; PÉREZ PÉREZ, Mª Jesús; ."Recent Advances in Thymidine Kinase 2 (TK2) Inhibitors and New Perspectives for Potential Applications.". (ISSN: 1568-0266). Current Topics in Medicinal Chemistry. 2012 , num 18(20) , p. 2981 - 2994

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• JOHAN VANDE VOORDE , Johan Vande; GAGO BADENAS, Federico; VRANCKEN , Kristof; LIEKENS , Sandra; BALZARINI , Jan; ."Characterization of pyrimidine nucleoside phosphorylase of Mycoplasma hyorhinis: implications for the clinical efficacy of nucleoside analogues.". (ISSN: 0264-6021). Biochemical Journal. 2012

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• CORTÉS CABRERA, Álvaro; GAGO BADENAS, Federico; MORREALE DE LEÓN, Antonio Jesús; ."A reverse combination of structure-based and ligand-based strategies for virtual screening". (ISSN: 0920-654X). Journal of Computer-Aided Molecular Design. 2012 , vol 26 , p. 319 - 327 .

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• CODERCH BOUÉ, Claire; MORREALE DE LEÓN, Antonio Jesús; GAGO BADENAS, Federico; ."Tubulin-based Structure-affinity Relationships for Antimitotic Vinca Alkaloids.". (ISSN: 1871-5206). ANTICANCER AGENTS IN MEDICINAL CHEMISTRY. 2012 , vol 12(3) , p. 219 - 225

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• CORTÉS CABRERA, Alvaro; GAGO BADENAS, Federico; MORREALE DE LEÓN, Antonio Jesús; ."A reverse combination of structure-based and ligand-based strategies for virtual screening". (ISSN: 0920-654X). Journal of Computer-Aided Molecular Design. 2012 , vol 26(3) , p. 319 - 327

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• BUEREN CALABUIG, Juan Antonio; NEGRI , Ana; MORREALE DE LEÓN, Antonio Jesús; GAGO BADENAS, Federico; ."Rationale 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 reactivity". (ISSN: 1477-0520). Organic and Biomolecular Chemistry. 2012 , vol 10(8) , p. 1543 - 1552

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• GAGO BADENAS, Federico; ."Reflections on the past 25 years". (ISSN: 0920-654X). Journal of Computer-Aided Molecular Design. 2012 , vol 26(1) , p. 45 - 45

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• BUEREN CALABUIG, Juan Antonio; CODERCH BOUÉ, Claire; RICO VIDAL, Eva; JIMÉNEZ RUIZ, Antonio; GAGO BADENAS, Federico; ."Mechanistic Insight into the Catalytic Activity of betabetaalfa-Metallonucleases from Computer Simulations: Vibrio vulnificus Periplasmic Nuclease as a Test Case". (ISSN: 1439-4227). Chembiochem : a European journal of chemical biology. 2011 , vol 12(17) , p. 2615 - 2622

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• FEUERHAHN , Sascha; GIRAUDON , Christophe; MARTÍNEZ-DÍEZ , Marta; BUEREN CALABUIG, Juan Antonio; GALMARINI , Carlos M.; GAGO BADENAS, Federico; EGLY , Jean-Marc; ."XPF-Dependent DNA Breaks and RNA Polymerase II Arrest Induced by Antitumor DNA Interstrand Crosslinking-Mimetic Alkaloids". (ISSN: 1074-5521). Chemistry and Biology. 2011 , vol 8 , num 18 , p. 988 - 999

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• CORTÉS CABRERA, Álvaro; GAGO BADENAS, Federico; MORREALE DE LEÓN, Antonio Jesús; GIL REDONDO, Rubén; PERONA , Almudena; ."VSDMIP 1.5: an automated structure- and ligand-based virtual screening platform with a PyMOL graphical user interface.". (ISSN: 0920-654X). Journal of Computer-Aided Molecular Design. 2011 , vol 25(9) , p. 813 - 824

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• BUEREN CALABUIG, Juan Antonio; GIRAUDON , Christophe; GALMARINI , Carlos María; EGLY , Jean Marc; GAGO BADENAS, Federico; ."Temperature-induced melting of double-stranded DNA in the absence and presence of covalently bonded antitumour drugs". (ISSN: 0305-1048). Nucleic Acids Research. 2011 , vol 39(18) , p. 8248 - 8257

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• DÍEZ-DACAL , Beatriz; CODERCH BOUÉ, Claire; GAGO BADENAS, Federico; PÉREZ-SALA , Dolores; ."Identification of Aldo-keto reductase AKR1B10 as a Selective Target for Modification and Inhibition by prostaglandin A1: Implications for Anti-tumoral Activity". (ISSN: 0008-5472). Cancer Research. 2011 , vol 71 , p. 4161 - 4171

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• CAMACHO-ARTACHO , Marta; ABET , Valentina; FRUTOS GAITE, Luis Manuel; GAGO BADENAS, Federico; ÁLVAREZ-BUILLA GÓMEZ, Julio; BURGOS GARCÍA, Carolina; ."Unusual Approach to 3-Aryl-2-aminopyridinesthrough a Radical Mechanism: Synthesis andTheoretical Rationale from Quantum MechanicalCalculations". (ISSN: 0022-3263). Journal of Organic Chemistry. 2011 , vol 5 , num 76 , p. 1452 - 1455

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• VAN POECKE , Sara; NEGRI , Ana; JANSSENS , Jolien; SOLAROLI , Nicola; KARLSSON , Anna; GAGO BADENAS, Federico; BALZARINI , Jan; VAN CALENBERGH , Serge; ."Synthesis, modeling and evaluation of 3'-(1-aryl-1H-tetrazol-5-ylamino)-substituted 3'-deoxythymidine derivatives as potent and selective human mitochondrial thymidine kinase inhibitors.". (ISSN: 1477-0520). Organic and Biomolecular Chemistry. 2010 , vol 9 , p. 892 - 901

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• M. LEAL , Juan F.; MARTÍNEZ-DÍEZ , Marta; GARCÍA HERNÁNDEZ, Verónica; DOMINGO GALÁN, Alberto; NEGRI , Ana; GALMARINI , Carlos M.; GAGO BADENAS, Federico; ."PM01183, a new DNA minor-groove covalent binder with potent in vitro and in vivo antitumour activity.". (ISSN: 0007-1188). British Journal of Pharmacology. 2010 , vol 161 , num 5 , p. 1099 - 1110

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• PEÓN , Antonio; GAGO BADENAS, Federico; GONZÁLEZ-BELLO , Concepción; ."Understanding the Key Factors that Control the Inhibition of Type II Dehydroquinase by (2R)-2-Benzyl-3-dehydroquinic Acids". (ISSN: 1860-7179). ChemMedChem. 2010 , vol 5 , num 10 , p. 1726 - 1733

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• LEAL , JF; GARCÍA HERNÁNDEZ, Verónica; BUEREN CALABUIG, Juan Antonio; NEGRI MARTÍNEZ, Ana; GAGO BADENAS, Federico; GUILLÉN-NAVARRO , María José; AVILÉS , Pablo; CUEVAS , Carmen; GARCÍA-FERNÁNDEZ , Luis Francisco; GALMARINI , Carlos María; ."PM01183, a new DNA minor groove covalent binder with potent in vitro and in vivo anti-tumour activity". (ISSN: 0007-1188). British Journal of Pharmacology. 2010 , vol 161 , num 5 , p. 1099 - 1110

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• VAN POECKE , Sara; NEGRI , Ana; GAGO BADENAS, Federico; VAN DAELE , Ineke; SOLAROLI , Nicola; KARLSSON , Anna; BALZARINI , Jan; VAN CALENBERGH , Serge; ."3'-[4-Aryl-(1,2,3-triazol-1-yl)]-3'-deoxythymidine Analogues as Potent and Selective Inhibitors of Human Mitochondrial Thymidine Kinase". (ISSN: 0022-2623). Journal of Medicinal Chemistry. 2010 , vol 53 , num 7 , p. 2902 -

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• GAGO BADENAS, Federico; NEGRI MARTÍNEZ, Ana; CAMARASA RIUS, María José; PÉREZ PÉREZ, Mª Jesús; ."Intramolecular Cation-pi Interactions As the Driving Force To Restrict the Conformation of Certain Nucleosides.". (ISSN: 0022-3263 ). The Journal of Organic Chemistry. 2010 , vol 75 , num 6 , p. 1974 - 1981

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• NEGRI , A.; RODRIGUEZ-LARREA , D.; MARCO , E.; JIMÉNEZ RUIZ, Antonio; SANCHEZ-RUIZ , J.M.; GAGO BADENAS, Federico; ."Protein-protein interactions at an enzyme-substrate interface: characterization of transient reaction intermediates throughout a full catalytic cycle of Escherichia coli thioredoxin reductase". (ISSN: 0887-3585). Proteins: Structure, Function and Genetics. 2010 , vol 78 , num 1 , p. 36 - 51

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• GIL-REDONDO , Rubén; KLETT , Javier; GAGO BADENAS, Federico; MORREALE DE LEÓN, Antonio Jesús; ."gCOMBINE: a graphical user interface to perform structure-based Comparative Binding Energy (COMBINE) analysis on a set of ligand-receptor complexes". (ISSN: 0887-3585). Proteins: Structure, Function and Genetics. 2010 , vol 1 , num 78 , p. 162 - 172

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• BRONCKAERS , Annelies; AGUADO , Leyre; NEGRI , Ana; CAMARASA RIUS, María José; BALZARINI , Jan; PÉREZ PÉREZ, Mª Jesús; GAGO BADENAS, Federico; LIEKENS , Sandra; ."Identification of aspartic acid-203 in human thymidine phosphorylase as an important residue for both catalysis and non-competitive inhibition by the small molecule "crystallization chaperone" 5'-O-tritylinosine (KIN59)". (ISSN: 0006-2952). Biochemical Pharmacology. 2009 , vol 78(3) , p. 231 - 240

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• LEAL , JF; MARTÍNEZ-DÍEZ , M; GARCÍA HERNÁNDEZ, Verónica; MONEO , Victoria; DOMINGO GALÁN, Alberto; BUEREN CALABUIG, Juan Antonio; NEGRI MARTÍNEZ, Ana; GAGO BADENAS, Federico; GUILLÉN-NAVARRO , María José; AVILÉS , Pablo; CUEVAS , Carmen; GARCÍA-FERNÁNDEZ , Luis Francisco; GALMARINI , Carlos María; ."Molecular pharmacology and antitumor activity of Zalypsis in several human cancer cell lines ". (ISSN: 0006-2952). Biochemical Pharmacology. 2009 , vol 78 , num 2 , p. 162 - 170

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• BRONCKAERS , Annelies; GAGO BADENAS, Federico; BALZARINI , Jan; LIEKENS , Sandra; ."The dual role of thymidine phosphorylase in cancer development and chemotherapy". (ISSN: 0198-6325). Medicinal Research Reviews. 2009 , vol 29 , num 6 , p. 903 - 953

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• BALZARINI , Jan; NEGRI , Ana; GAGO BADENAS, Federico; LIEKENS , Sandra; VAN CALENBERGH , Serge; ."Human Mitochondrial Thymidine Kinase (TK-2) is Selectively Inhibited by 3'-Thiourea Derivatives of beta-Thymidine. Identification of residues crucial for both inhibition and catalytic activity". (ISSN: 0026-895X). Molecular Pharmacology. 2009 , vol 75(5) , p. 1127 - 1136

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• RICO , E.; ALZATE , J.F.; ARIAS , A.A.; MORENO-MATEOS , D.; CLOS , J.; GAGO BADENAS, Federico; MORENO , I.; DOMINGUEZ , M.; JIMÉNEZ RUIZ, Antonio; ."Leishmania infantum expresses a mitochondrial nuclease homologous to EndoG that migrates to the nucleus in response to an apoptotic stimulus". (ISSN: 0166-6851). Molecular and Biochemical Parasitology. 2009 , vol 163 , num 1 , p. 28 - 38

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• GAGO BADENAS, Federico; BALZARINI , Jan; PÉREZ PÉREZ, Mª Jesús; ."Structure, physiological role, and specific inhibitors of human thymidine kinase 2 (TK2): Present and future". (ISSN: 0198-6325). Medicinal Research Reviews. 2008 , vol 28(5) , p. 797 - 820

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• PANDE , Vineet; RAMOS , Maria Joao; GAGO BADENAS, Federico; ."The protein kinase inhibitor balanol: structure-activity relationships and structure-based computational studies". (ISSN: 1871-5206). ANTICANCER AGENTS IN MEDICINAL CHEMISTRY. 2008 , vol 8(6) , p. 638 - 645

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• FAMILIAR , Olga; GAGO BADENAS, Federico; CAMARASA RIUS, María José; PÉREZ PÉREZ, Mª Jesús; ."Exploring Acyclic Nucleoside Analogues as Inhibitors of Mycobacterium tuberculosis Thymidylate Kinase". (ISSN: 1860-7179). ChemMedChem. 2008 , vol 3(7) , p. 1083 - 1093

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• MATESANZ , Ruth; CODERCH BOUÉ, Claire; GAGO BADENAS, Federico; DÍAZ , Juan Fernando; ."Optimization of taxane binding to microtubules: binding affinity dissection and incremental construction of a high-affinity analog of Paclitaxel". (ISSN: 1074-5521). Chemistry and Biology. 2008 , vol 15(6) , p. 573 - 585

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• CASADO , Jose A.; RIO , Paula; MARCO TEJÓN, Esther; GARCÍA HERNÁNDEZ, Verónica; DOMINGO GALÁN, Alberto; PÉREZ , Laura; TERCERO , Juan Carlos; VAQUERO LÓPEZ, Juan José; ALBELLA , Beatriz; GAGO BADENAS, Federico; BUEREN , Juan A.; ."Relevance of the Fanconi anemia pathway in the response of human cells to trabectedin". (ISSN: 1535-7163). Molecular Cancer Therapeutics. 2008 , vol 7 , num 5 , p. 1309 - 1318

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• MARCO TEJÓN, Esther; GAGO BADENAS, Federico; ."Overcoming the Inadequacies or Limitations of Experimental Structures as Drug Targets by Using Computational Modeling Tools and Molecular Dynamics Simulations". (ISSN: 1860-7179). ChemMedChem. 2007 , vol 2(10) , p. 1388 - 1401

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• NEGRI , Ana; MARCO TEJÓN, Esther; DAMBORSKY , Jiri; GAGO BADENAS, Federico; ."Stepwise dissection and visualization of the catalytic mechanism of haloalkane dehalogenase LinB using molecular dynamics simulations and computer graphics". (ISSN: 1093-3263). Journal of Molecular Graphics and Modelling. 2007 , vol 26(3) , p. 643 - 651

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• NEGRI , Ana; MARCO TEJÓN, Esther; GAGO BADENAS, Federico; ."Antitumor Activity, X-ray Crystal Structure, and DNA Binding Properties of Thiocoraline A, a Natural Bisintercalating Thiodepsipeptide". (ISSN: 0022-2623). Journal of Medicinal Chemistry. 2007 , vol 50(14) , p. 3322 - 3333

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• MOLINA , A.; VAQUERO LÓPEZ, Juan José; GARCÍA NAVÍO, José Luis; ÁLVAREZ-BUILLA GÓMEZ, Julio; DE PASCUAL-TERESA , B.; GAGO BADENAS, Federico; RODRIGO LÓPEZ, María Melia; ."Novel DNA Intercalators Based on the Pyridazino[1',6':1,2]pyrido[4,3-b]indol-5-inium System". (ISSN: 0022-3263). Journal of Organic Chemistry. 1999 , vol 64 , p. 3907 - 3915

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• PASTOR , J.; SIRO , J.; RODRIGO , M.M.; PASTOR , M.; GARCIA-NAVIO , J.L.; VAQUERO , J.J.; DE PASCUAL-TERESA , B.; GAGO BADENAS, Federico; ÁLVAREZ-BUILLA GÓMEZ, Julio; ."Azino Fused Benzimidazolium Salts as DNA Intercalating Agents. 2". (ISSN: 0022-3263). Journal of Organic Chemistry. 1997 , vol 62 , p. 5476 - 5483

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• PASTOR FERNÁNDEZ, Joaquín Ángel; SIRO HERRERO, Jorge Gregorio; PASTOR MAESO, Manuel; GARCÍA NAVÍO, José Luis; VAQUERO LÓPEZ, Juan José; GAGO BADENAS, Federico; DE PASCUAL-TERESA , B.; ÁLVAREZ-BUILLA GÓMEZ, Julio; RODRIGO , M Melia; ."Azino Fused Benzimidazolium Salts as DNA Intercalating Agents. 2". (ISSN: 0022-3263). Journal of Organic Chemistry. 1997 , vol 62 , p. 5476 - 5483

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• PASTOR , J.; SIRO , J.G.; GARCÍA NAVÍO, José Luis; VAQUERO LÓPEZ, Juan José; ÁLVAREZ-BUILLA GÓMEZ, Julio; GAGO BADENAS, Federico; DE PASCUAL-TERESA , B.; PASTOR , M.; RODRIGO LÓPEZ, María Melia; ."Azino-Fused Benzimidazolium Salts as DNA Intercalating Agents". (ISSN: 0022-3263). Journal of Organic Chemistry. 1997 , vol 62 , p. 5476 - 5483

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• MAGRANS , J.O.; ORTIZ , A.R.; LEBOUILLE , P.H.P.; SANCHEZ-QUESADA , J.; PRADOS , P.; PONS , M.; GAGO BADENAS, Federico; MENDOZA , J.; ."A designed non-peptidic receptor that mimics the phosphocholine binding site of the McPC603 antibody.". (ISSN: 0570-0833). Angewandte Chemie - International Edition in English. 1996 , num 35 , p. 1712 - 1715

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• MOLINA PONCE, Andrés; VAQUERO LÓPEZ, Juan José; GARCÍA NAVÍO, José Luis; ÁLVAREZ-BUILLA GÓMEZ, Julio; DE PASCUAL TERESA , B.; GAGO BADENAS, Federico; RODRIGO GARCÍA, María Nuria; BALLESTEROS GONZÁLEZ, María Milagros; ."Synthesis and DNA binding properties of gamma-carbolinium derivatives and benzologues". (ISSN: 0022-3263). Journal of Organic Chemistry. 1996 , vol 61 , p. 5578 - 5599

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• MOLINA , A.; VAQUERO LÓPEZ, Juan José; GARCIA-NAVIO , J.L.; ÁLVAREZ-BUILLA GÓMEZ, Julio; PASCUAL-TERESA , B.; GAGO BADENAS, Federico; RODRIGO , M.M.; BALLESTEROS , M.; ."Synthesis and DNA binding properties of gamma-carbolinium derivatives and benzologues". (ISSN: 0022-3263). Journal of Organic Chemistry. 1996 , vol 61 , p. 5587 - 5599

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• CARCELLER MARTÍ, Rosa; GARCÍA NAVÍO, José Luis; IZQUIERDO CEINOS, María Luisa; ÁLVAREZ-BUILLA GÓMEZ, Julio; FAJARDO GONZÁLEZ, Mariano; GÓMEZ SAL, María del Pilar; GAGO BADENAS, Federico; ."Azinium-N-(2´-azinyl)aminides: Synthesis, Structure and Reactivity". (ISSN: 00404020). Tetrahedron. 1994 , vol 50 , p. 4995 - 5012

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• BURGOS GARCÍA, Carolina; GAGO BADENAS, Federico; ÁLVAREZ-BUILLA GÓMEZ, Julio; MODESTO , Orozco; JOSE , Gallego; LUQUE , F José; RODRIGO , Melia M; ."DNA Sequence-Specific Reading by Echinomicyn: Role of Hydrogen Bonding and Stacking Interactions". (ISSN: 0022-2623). Journal of Medicinal Chemistry. 1994 , vol 37 , p. 1602 - 1609

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Artículos Electrónicos

No existen datos en este apartado

Congresos

• GAGO BADENAS, Federico; FRUTOS GAITE, Luis Manuel; ."XIVth International Congress of SBE (Sociedad de Biofísica de España)". UNIVERSIDAD ALCALÁ. (11/06/2014 - 13/06/2014).

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• VAQUERO LÓPEZ, Juan José; DOMINGO GALÁN, Alberto; GAGO BADENAS, Federico; GARCIA HERNANDEZ, Veronica; ."A highly sensitive DNA-binding assay for ligand screening and profiling based on melting curve analysis of FRET-labeled DNA oligonucleotides ". Congreso. Nacional. "I Biennal Meeting of the Chemical Biology Group". SANTIAGO DE COMPOSTELA (08/03/2012 - 09/03/2012).

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• BUEREN CALABUIG, Juan Antonio; RICO VIDAL, Eva; OLIVA CORREIA, Cristina; JIMÉNEZ RUIZ, Antonio; GAGO BADENAS, Federico; ."Structural insights into Leishmania infantum endoG active site and analysis of the reaction mechanism ". Congreso. Internacional. "Second Iberic Meeting on Medicinal Chemistry: G rotein-Coupled Receptors and Enzymes in Drug Discovery ". Oporto "(Portugal)". (12/06/2011 - 15/06/2011).

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• BUEREN CALABUIG, Juan Antonio; GALMARINI , Carlos María; CUEVAS , Carmen; GAGO BADENAS, Federico; ."Melting DNA on the computer to assess the stabilizing effect of some covalent antitumour minor groove binders". Congreso. Internacional. "VIII Reunión de ácidos nucléicos y nucleósidos ". Sevilla (08/06/2011 - 10/06/2011).

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• GAGO BADENAS, Federico; MORREALE DE LEÓN, Antonio Jesús; ."Taller práctico de docking y cribado virtual: uso de herramientas computacionales en el diseño de fármacos". Nacional. (01/04/2011 - 31/07/2011).

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• BUEREN CALABUIG, Juan Antonio; CUEVAS , Carmen; GALMARINI , Carlos María; GAGO BADENAS, Federico; ."Molecular dynamics simulations of DNA melting in the presence and absence of some antitumour drugs covalently bonded in the minor groove ". Congreso. Internacional. "IV Spanish-Portuguese Biophysical Congress". Zaragoza (07/07/2010 - 10/07/2010).

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• BUEREN CALABUIG, Juan Antonio; NEGRI MARTÍNEZ, Ana; GALMARINI , Carlos María; CUEVAS , Carmen; GAGO BADENAS, Federico; ."Structural basis for the binding of the new antitumor drug Zalypsis to selected DNA triplets using molecular dynamics ". Congreso. Internacional. Jaca (11/06/2009 - 12/06/2009).

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• RICO , E.; ALZATE , J.F.; MORENO , D.; BUEREN , J.; GAGO BADENAS, Federico; JIMÉNEZ RUIZ, Antonio; ." Structural and functional analysis of Leishmania infantum EndoG". Congreso. Internacional. "WorldLeish 4". Lucknow "(India)". (03/02/2009 - 07/02/2009).

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• BUEREN CALABUIG, Juan Antonio; NEGRI MARTÍNEZ, Ana; GAGO BADENAS, Federico; ."A computational study of interstrand cross-link formation by Mitomycin C in the DNA minor groove using Molecular Dynamics". Workshop. Indefinido. "International Worskhop in memoriam of Angel Ramírez Ortiz. ¿Structural bioinformatics and beyond¿". Madrid (25/01/2009 - 28/01/2009).

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• MORENO-MATEOS , D.; RICO , E.; ALZATE , J.F.; ARIAS , A.A.; CLOS , J.; GAGO BADENAS, Federico; JIMÉNEZ RUIZ, Antonio; ." Conservation of an endonuclease G like protein in Leishmania infantum.". Congreso. Internacional. "Molecular Parasitology Meeting XIX". Woodshole "(Estados Unidos)". (21/09/2008 - 25/09/2008).

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• RICO , E.; ALZATE , J.F.; MORENO , D.; ARIAS , A.A.; CLOS , J.; GAGO BADENAS, Federico; JIMÉNEZ RUIZ, Antonio; ." L. Infantum mitochondrion contains a nuclease homologous to EndoG that migrates to the nucleus in response to an apoptotic stimulus". Congreso. Internacional. Woodshole "(Estados Unidos)". (21/09/2008 - 25/09/2008).

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• BUEREN CALABUIG, Juan Antonio; NEGRI MARTÍNEZ, Ana; GAGO BADENAS, Federico; ."A computational study of interstrand cross-link formation in the DNA minor groove by mitomycin C using molecular dynamics". Congreso. Internacional. "Grand Challenges in Computational Biology". Barcelona (02/06/2008 - 04/06/2008).

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• BUEREN CALABUIG, Juan Antonio; NEGRI MARTÍNEZ, Ana; GAGO BADENAS, Federico; ." A computational study of interstrand cross-link formation by Mitomycin C in the DNA minor groove using Molecular Dynamics ". Congreso. Internacional. "VI Reunión Sobre Ácidos Nucleicos y Nucleósidos". Valencia (22/11/2007 - 23/11/2007).

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• GAGO BADENAS, Federico; ."Estudios ‘in silico' de las interacciones ligando-receptor: aplicaciones al diseño y optimización de fármacos.". Nacional. "XIII Congreso Nacional de la Sociedad Española de Química Terapéutica". Santiago (09/09/2003 - ).

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• GAGO BADENAS, Federico; ."Yondelis® [trabectedin, ET-743". Nacional. "IV PharmaMar MoA Symposium". Madrid (20/01/2003 - ).

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• MARCO TEJÓN, Esther; GARCÍA-NIETO MORENO, Raquel; MANZANARES , I.; CUENCA FERNÁNDEZ, Eduardo; GAGO BADENAS, Federico; ."Structural similarity between zinc finger-DNA complexes and DNA complexes containing three tandemly bound ecteinascidin ET743 molecules. (Póster)". Internacional. "International Conference on Molecular Targets and Cancer Therapeutics". "(Estados Unidos)". (29/10/2002 - ).

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• GAGO BADENAS, Federico; ."Discovering new drug candidates in the postgenomic era". Internacional. "III Jornadas de Bioinformática- International Symposium on Bioinformatics and Computational Biology.". (18/09/2002 - ).

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• GAGO BADENAS, Federico; .""Docking" y "ranking": dos asignaturas pendientes en el modelado molecular de complejos ligando-receptor.". Nacional. "Reunió de la Xarxa de Modelització Molecular.". Barcelona (24/01/2002 - ).

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• GARCÍA-NIETO MORENO, Raquel; MARCO TEJÓN, Esther; MANZANARES , A.; CUEVAS , I.; GAGO BADENAS, Federico; ."Avances en la química y biología de las ecteinascidinas, una nueva y prometedora clase de agentes antitumorales". Nacional. "XXIV Congreso de la Sociedad Española de Bioquímca y Biología Molecular". Valencia (18/09/2001 - ).

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• MENDIETA GÓMEZ, Jesús; RAMIREZ , Galo; GAGO BADENAS, Federico; ."Simulaciones mediante dinámica molecular de los cambios conformacionales del receptor de Glutamato en presencia y ausencia de agonistas". Nacional. "XXIV Congreso Sociedad Española de Bioquímica y Biología Molecular". Valencia (18/09/2001 - ).

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• MENDIETA GÓMEZ, Jesús; RAMIREZ , Galo; GAGO BADENAS, Federico; ."Simulaciones mediante dinámica molecular de los cambios conformacionales del receptor de Glutamato en presencia y ausencia de agonistas". Nacional. "XII Congreso Nacional de la Sociedad Española de Química Terapeútica". Sevilla (11/09/2001 - ).

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• SSAN-FELIX , A.; CHAMORRO , C.; LUENGO , S.M.; PEREZ-PEREZ , M.J.; GAGO BADENAS, Federico; JIMENO , M.L.; CAMARAZA , M.J.; ."Síntesis y estudio conformacional de nuevos biciclo y triciclo nucleósidos". Nacional. "XII Congreso nacional de la Sociedad Química Terapéutica". Sevilla (11/09/2001 - ).

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• MENDIETA GÓMEZ, Jesús; PRIEGO , Eva Mª; PEREZ-PEREZ , Mª Jesus; CAMARASA , Mª Jose; GAGO BADENAS, Federico; ."Timidina fosforilasa: un blanco para el diseño de nuevos fármacos anti-angiogénicos". Nacional. "XII Congreso Nacional de la Sociedad Española de Química Terapéutica". Sevilla (11/09/2001 - ).

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• GARCÍA-NIETO MORENO, Raquel; MARCO TEJÓN, Esther; GAGO BADENAS, Federico; ."Reconocimiento de secuencias de ADN por dedos de zinc: comparación entre los factores de transcripción EGR-1(Zif-268) y Sp1". Nacional. "III Reunión de Ácidos Nucleicos y Nucleósidos (RANN III)". Santiago (19/07/2001 - ).

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• MARCO TEJÓN, Esther; GARCÍA-NIETO MORENO, Raquel; GAGO BADENAS, Federico; ."Transición B®A en el ADN tras la unión cabeza-cola de tres moléculas de ecteinascidina ET743 a tres sitios adyacentes en el promotor proximal del gen p73 humano". Nacional. "III Reunión de Acidos Nucleicos y Nucleósidos (RANN III)". Santiago (19/07/2001 - ).

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• MENDIETA GÓMEZ, Jesús; RAMIREZ , Galo; GAGO BADENAS, Federico; ."Simulaciones mediante dinámica molecular de los cambios conformacionales del receptor de Glutamato en presencia y ausencia de agonistas". Nacional. "X Jornada de farmacólogos de laComunidad de Madrid". Madrid (30/05/2001 - ).

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• MARCO TEJÓN, Esther; GARCÍA-NIETO MORENO, Raquel; GAGO BADENAS, Federico; ."Unión cabeza-cola de tres moléculas de Ecteinascidina ET743 a tres sitios adyacentes en el promotor próximal del gen P73 humano". Nacional. "X Jornada de farmacólogos de la Comunidad de Madrid". Madrid (30/05/2001 - ).

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• GARCÍA-NIETO MORENO, Raquel; MANZANARES , I.; CUEVAS MARCHANTE , Carmen; GAGO BADENAS, Federico; ."From sequence to structure to function: the importance of overlapping binding sites for zinc finger-containing proteins on transcription regulation and possible modulation by anticancer ecteinascidins.". Internacional. "International Meetings on Biology, Workshop on Structural Genomics and Bioinformatics". Madrid (12/03/2001 - ).

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• GARCÍA-NIETO MORENO, Raquel; MANZANARES , I.; CUEVAS MARCHANTE, Carmen; GAGO BADENAS, Federico; ."From sequence to structure to function: the importance of overlapping binding sites for zinc finger-containing proteins on transcription regulation and possible modulation by anticancer ecteinascidins". Nacional. "International Meetings on Biology, Workshop on Structural Genomics and Bioinformatics". Madrid (12/03/2001 - ).

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• GAGO BADENAS, Federico; ."A Zinc Finger-induced DNA Bend is a Likely Target for Antitumour Ecteinascidin ET473". Internacional. "STRUCTURE-BASED DRUG DESIGN". "(Reino Unido)". (15/12/2000 - ).

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• GAGO BADENAS, Federico; ."Herramientas computacionales utilizadas en el diseño de fármacos basado en la estructura del receptor". Nacional. "Estrategias y nuevas tecnologías para el descubrimiento de fármacos". Toledo (26/10/2000 - ).

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• KMUNICEK , J.; LUENGO , S.; GAGO BADENAS, Federico; RAMÍREZ ORTIZ, Ángel; WADE , R.; DAMBORSKY , J.; ."Application of Comparative Binding Energy (COMBINE) Analysis for the Design of Environmental Biocatalysts. (Presentación oral).". Internacional. "QSAR 2000". "(Bulgaria)". (16/09/2000 - ).

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• RINCÓN , E.; MORENO , M.; FERNANDEZ , G.; JIMENEZ , S.; RUIZ , S.; VEGA RAMIRO, Juan Antonio; GAGO BADENAS, Federico; VAQUERO LÓPEZ, Juan José; DOMINGO GALÁN, Alberto; ."Diseño de patrones para PCR competitiva.". Nacional. "XXIII Congreso de la Sociedad Española de Bioquímica y Biología Molecular". Granada (13/09/2000 - ).

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• KMUNICEK , J.; DAMBORSKY , J.; WADE , R.; LUENGO , S.; GAGO BADENAS, Federico; RAMÍREZ ORTIZ, Ángel; ."Design of Haloalkane Dehalogenase Using Comparative Binding Energy (COMBINE) analysis. (Presentación en póster)". Internacional. "5th International Symposium and Exhibition on Enrironmental Contamination in Central and Eastern Europe". Praga "(República Checa)". (12/09/2000 - ).

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• GARCÍA NAVÍO, José Luis; ÁLVAREZ-BUILLA GÓMEZ, Julio; GAGO BADENAS, Federico; DOMINGO GALÁN, Alberto; VAQUERO LÓPEZ, Juan José; ."Nuevos intercalantes de ADN basados en el sistema de aza-quinolizinio". Nacional. "II Reunión Nacional de Nucleósidos y Nucleótidos". San Lorenzo de el Escorial (22/10/1999 - ).

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• CAMARAZA , M.J.; PEREZ-PEREZ , M.J.; VELAZQUEZ , S.; SAN FELIX , A.; JIMENO , M.L.; ALVAREZ , R.; CHAMORRO , C.; LOBATON , E.; TUÑON , V.; PEREZ , C.; GAGO BADENAS, Federico; DE CLERQ , E.; BALZARINI , L.; ."HIV-1 reverse transcriptase inhibitors: why are TSAO derivatives so unique?". Internacional. "First Euroconference on Carbohydrates in Drug Research". "(Italia)". (16/09/1999 - ).

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• GAGO BADENAS, Federico; ."Molecular modeling: From Pharmacology to Chemistry". Nacional. "XXII National Congress of the Spanisch Society of Pharmacology - XI National Congress of the Spanisch Society of Therapeutic Chemistry". Valencia (14/09/1999 - ).

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• GAGO BADENAS, Federico; ."Uso de estructuras cristalográficas en el modelado molecular: aplicación al reconocimiento fármaco-receptor". Nacional. "XI Symposium del grupo especializado de cristalografía". Alcalá de Henares (09/06/1999 - ).

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• GAGO BADENAS, Federico; ."Comparative binding energy (COMBINE) analysis: Developmkent and improvements". Internacional. "Talking proteins: An EMBO Workshop on Sequence Analysis, Modelling and Simulation". "(Alemania)". (16/09/1998 - ).

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• GARCIA NIETO , R.; PEREZ , C.; CHECA , A.; GAGO BADENAS, Federico; ."Molecular model of the interaction between nimesulide and human cyclooxygenase". Internacional. "11th EULAR Symposium (The European League Against Rheumatism)". "(Suiza)". (05/09/1998 - ).

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• PASTOR , M.; GAGO BADENAS, Federico; CRUCIANI , G.; ."Comparative Binding Energy (COMBINE) Analysis on a Series of Clycogen Phosphorylase Inhibitors. Comparison with GRID/GOLPE Models". Internacional. "12th European Symposium on Quantitative Structure-Activity Relationship: Molecular Modelling and Prediction of Bioactivity". "(Dinamarca)". (23/08/1998 - ).

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• GAGO BADENAS, Federico; ."Método COMBINE aplicado al análisis de la interacción fármaco-receptor". Nacional. "IMIM". Barcelona (25/06/1998 - ).

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• PASTOR , M.; PEREZ , C.; GAGO BADENAS, Federico; ."Sturcture-based QSAR models of a symmetic receptor. Simulating alternative binding of the ligands". Internacional. "The Second Electronic Molecular Graphics and Modelling Conference-Virtual Environments International (VEI)". Oxford "(Reino Unido)". (01/11/1997 - ).

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• GAGO BADENAS, Federico; ."Modelado molecular de la interacción DNA y fármacos antitumorales". Nacional. "Jornadas sobre Interacción de Ácidos Nucleicos con otras Biomoléculas: de la Biología a la Química". Sevilla (30/10/1997 - ).

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• GAGO BADENAS, Federico; ."Modelado molecular". Internacional. "Reunión de Ácidos Nucleicos y Nucleósidos". Girona (17/10/1997 - ).

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• MOLINA , A.; PASTOR , J.; GARCIA-NAVIO , J.L.; ÁLVAREZ-BUILLA GÓMEZ, Julio; VAQUERO LÓPEZ, Juan José; DE PASCUAL TERESA , B.; GAGO BADENAS, Federico; RODRIGO , M.M.; ."Nuevos agentes bis-intercalantes de ADN". Nacional. "X Congreso de la Sociedad Española de Química Terapéutica". Oviedo (23/09/1997 - ).

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• MOLINA PONCE, Andrés; PASTOR FERNÁNDEZ, Joaquín Ángel; GARCÍA NAVÍO, José Luis; ÁLVAREZ-BUILLA GÓMEZ, Julio; VAQUERO LÓPEZ, Juan José; DE PASCUAL TERESA , B.; GAGO BADENAS, Federico; RODRIGO LÓPEZ, María Melia; ."Nuevos agentes bis-intercalantes de ADN". Nacional. "X Congreso de la Sociedad Española de Química Terapéutica". Oviedo (23/09/1997 - ).

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• GAGO BADENAS, Federico; ."Modelo Molecular de la Interacción entre la Nimesulida y la ciclooxigenasa 2 humana". Internacional. "III Symposium Internacional III Symposium Internacional de Reumatología - V Symposium de Inflamación". Sevilla (10/04/1997 - ).

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• GAGO BADENAS, Federico; ."A computational approach to DNA recognition by intercalating and bis-intercalating ligands". Internacional. "European Research Conference-Supramolecular Chemistry: Molecular Recognition and Drug-Receptor Interactions". Salamanca (29/08/1996 - ).

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• CHECA , A.; ORTIZ , A.R.; PASCUAL TERESA , B.; GAGO BADENAS, Federico; ."Approximating calculated binding energy differences for enzyme-inhibitor complexes to experimental values". Internacional. "York Meeting on Molecular Interactions". York "(Reino Unido)". (16/04/1996 - ).

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• RAMIREZ , A.; PISABARRO , M.T.; GAGO BADENAS, Federico; ."Toward a more rational design of enzyme inhibitors: phospholipase A2 as a test case". Internacional. "Int. Meeting on Biology, Workshop on Computational Approaches in the Analysis and Engineering of Proteins". Madrid (14/11/1994 - ).

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• CARCELLER MARTÍ, Rosa; IZQUIERDO CEINOS, María Luisa; GARCÍA NAVÍO, José Luis; GAGO BADENAS, Federico; ÁLVAREZ-BUILLA GÓMEZ, Julio; ."Iluros de 1-(2-Piridilimino)piridinio, Nuevos Reactivos para a Obtencion de 2-Aminopiridinas". Jornada. Nacional. "VI Jornadas de Química Orgánica". Murcia (1992 - ).

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Tesis

• CODERCH BOUÉ, Claire; "Exploración de los sitios de unión de antitumorales a la tubulina mediante herramientas computacionales y simulaciones de dinámica molecular". Director: GAGO BADENAS, Federico, . UNIVERSIDAD DE ALCALA. Fecha de lectura: 06/2012. .

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• BUEREN CALABUIG, Juan Antonio; "Modelado molecular de la interacción de fármacos antitumorales y nucleasas con el ADN". Director: GAGO BADENAS, Federico, . UNIVERSIDAD DE ALCALA. Fecha de lectura: 12/2011. APTO.

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• RICO VIDAL, Eva; "Estudio de la nucleasa EndoG en el protozoo Leishmania infantum: caracterización e implicaciones en la supervivencia y muerte del parásito". Director: JIMÉNEZ RUIZ, Antonio, GAGO BADENAS, Federico, . Mención Europea . UNIVERSIDAD DE ALCALA. Fecha de lectura: 15/11/2010. Sobresaliente cum laude.

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• MORENO MATEOS, David; "Estrategias celulares y moleculares en el cribado de nuevos agentes anti-Leishmania". Director: JIMÉNEZ RUIZ, Antonio, GAGO BADENAS, Federico, . UNIVERSIDAD DE ALCALA. Fecha de lectura: 24/07/2010. Sobresaliente cum laude.

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• NEGRI , Ana; "Estudios in silico de la afinidad de distintos ligandos por sus macromoléculas diana". Director: GAGO BADENAS, Federico, . UNIVERSIDAD DE ALCALA. Fecha de lectura: 01/12/2008. Sobresaliente cum laude.

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• GAGO BADENAS, Federico; "Medidas de la hidrofobicidad por técnicas cromatográficas y su aplicación a QSAR". Director: ÁLVAREZ-BUILLA GÓMEZ, Julio, . UNIVERSIDAD DE ALCALA. Fecha de lectura: 06/06/1987. Sobresaliente cum laude.

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