A Critical Assessment of Docking Programs and Scoring Functions von Warren, Gregory L, Andrews, C. Webster, Capelli, Anna-Maria, Clarke, Brian, LaLonde, Judith, Lambert, Millard H, Lindvall, Mika, Nevins, Neysa, Semus, Simon F, Senger, Stefan, Tedesco, Giovanna, Wall, Ian D, Woolven, James M, Peishoff, Catherine E, Head, Martha S

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Identification and characterization of novel NMDA receptor antagonists selective for NR2A- over NR2B-containing receptors von Bettini, Ezio, Sava, Anna, Griffante, Cristiana, Carignani, Corrado, Buson, Alberto, Capelli, Anna Maria, Negri, Michele, Andreetta, Filippo, Senar-Sancho, Sergio A, Guiral, Lorena, Cardullo, Francesca

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Heteroaryl-Substituted 4-(1H-pyrazol-1-yl)-5,6-dihydro-1H-pyrrolo[2,3-d]pyrimidine Derivatives as Potent and Selective Corticotropin-Releasing Factor Receptor-1 Antagonists von Sabbatini, Fabio Maria, Di Fabio, Romano, St-Denis, Yves, Capelli, Anna-Maria, Castiglioni, Emiliano, Contini, Stefania, Donati, Daniele, Fazzolari, Elettra, Gentile, Gabriella, Micheli, Fabrizio, Pavone, Francesca, Rinaldi, Marilisa, Pasquarello, Alessandra, Zampori, Maria Grazia, Di Felice, Pina, Zarantonello, Paola, Arban, Roberto, Perini, Benedetta, Vitulli, Giovanni, Benedetti, Roberto, Oliosi, Beatrice, Worby, Angela

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Cyclopenta[d]pyrimidines and Dihydropyrrolo[2,3-d]pyrimidines as Potent and Selective Corticotropin-Releasing Factor 1 Receptor Antagonists von Arban, Roberto, Benedetti, Roberto, Bonanomi, Giorgio, Capelli, Anna-Maria, Castiglioni, Emiliano, Contini, Stefania, Degiorgis, Fabio, Di Felice, Pina, Donati, Daniele, Fazzolari, Elettra, Gentile, Gabriella, Marchionni, Chiara, Marchioro, Carla, Messina, Flavia, Micheli, Fabrizio, Oliosi, Beatrice, Pavone, Francesca, Pasquarello, Alessandra, Perini, Benedetta, Rinaldi, Marilisa, Sabbatini, Fabio M., Vitulli, Giovanni, Zarantonello, Paola, Di Fabio, Romano, St-Denis, Yves

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Unbinding Pathways of VEGFR2 Inhibitors Revealed by Steered Molecular Dynamics von Capelli, Anna Maria, Costantino, Gabriele

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Metadynamics Simulations Distinguish Short- and Long-Residence-Time Inhibitors of Cyclin-Dependent Kinase 8 von Callegari, Donatella, Lodola, Alessio, Pala, Daniele, Rivara, Silvia, Mor, Marco, Rizzi, Andrea, Capelli, Anna Maria

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5-{2-[4-(2-Methyl-5-quinolinyl)-1-piperazinyl]ethyl}-2(1H)-quinolinones and 3,4-dihydro-2(1H)-quinolinones: Dual-acting 5-HT1 receptor antagonists and serotonin reuptake inhibitors... von BROMIDGE, Steven M, ARBAN, Roberto, PASQUARELLO, Alessandra, SPADA, Simone K, WORBY, Angela, ZONZINI, Laura, ZUCCHELLI, Valeria, BERTANI, Barbara, BORRIELLO, Manuela, CAPELLI, Anna-Maria, DI-FABIO, Romano, FAEDO, Stefania, GIANOTTI, Massimo, GORDON, Laurie J, GRANCI, Enrica

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Discovery and Optimization of Pyridazinones as PI3Kδ Selective Inhibitors for Administration by Inhalation von Bruno, Paolo, Micoli, Alessandra, Corsi, Mauro, Pala, Daniele, Guariento, Sara, Fiorelli, Claudio, Ronchi, Paolo, Fioni, Alessandro, Gallo, Paola Maria, Marenghi, Giulia, Bertolini, Serena, Capacchi, Silvia, Mileo, Valentina, Biagetti, Matteo, Capelli, Anna Maria

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Unbinding Pathways from the Glucocorticoid Receptor Shed Light on the Reduced Sensitivity of Glucocorticoid Ligands to a Naturally Occurring, Clinically Relevant Mutant Receptor von Capelli, Anna Maria, Bruno, Agostino, Entrena Guadix, Antonio, Costantino, Gabriele

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Application of an “inhalation by design” approach to the identification and in-vitro evaluation of novel purine based PI3Kδ inhibitors von Mazzucato, Roberta, Roberti, Marinella, Capelli, Anna Maria, Rancati, Fabio, Biagetti, Matteo, Fiorelli, Claudio, Bruno, Paolo, Ronchi, Paolo, Bertolini, Serena, Corsi, Mauro, Pala, Daniele

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Discovery of CHF-6523, an Inhaled Selective PI3Kδ Inhibitor for the Treatment of Chronic Obstructive Pulmonary Disease von Bruno, Paolo, Pala, Daniele, Micoli, Alessandra, Corsi, Mauro, Accetta, Alessandro, Carzaniga, Laura, Ronchi, Paolo, Fiorelli, Claudio, Formica, Michele, Pizzirani, Daniela, Mazzucato, Roberta, Guariento, Sara, Bertolini, Serena, Martucci, Cataldo, Allen, Andrew Dennis, Mileo, Valentina, Capacchi, Silvia, Gallo, Paola Maria, Fioni, Alessandro, Xanxo Fernandez, Sergio, Villetti, Gino, Puccini, Paola, Civelli, Maurizio, Guala, Matilde, Retini, Michele, Martinelli, Prisca, Visentini, Filippo, Pavoni, Valentina, Daldosso, Matteo, Fontana, Stefano, Biagetti, Matteo, Capelli, Anna Maria

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Novel Pyrrolidine Derivatives of Budesonide as Long Acting Inhaled Corticosteroids for the Treatment of Pulmonary Inflammatory Diseases von Ghidini, Eleonora, Marchini, Gessica, Capelli, Anna Maria, Carnini, Chiara, Cenacchi, Valentina, Fioni, Alessandro, Facchinetti, Fabrizio, Rancati, Fabio

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Discovery of a Potent, Selective, and Orally Bioavailable Tool Compound for Probing the Role of Lysophosphatidic Acid Type 2 Receptor Antagonists in Fibrotic Disorders von Armani, Elisabetta, Rizzi, Andrea, Iotti, Nicolò, Saccani, Francesca, Di Lascia, Maria Rosaria, Tigli, Laura, Pappani, Alice, Marchini, Gessica, Murgo, Annalisa, Capelli, Anna Maria, Delcanale, Maurizio, Puccini, Paola, Villetti, Gino, Civelli, Maurizio, Beato, Claudia, Giuliani, Marta, Mundi, Claudia, Murarolli, Francesca, Pagano, Mafalda, Raveglia, Luca F., Remelli, Rosaria, Amari, Gabriele

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GLIMPSED: An Improved Docking Protocol for Cognate Docking von Rizzi, Andrea, Ciacci, Andrea, Capelli, Anna Maria

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Atropisomerism and Conformational Equilibria: Impact on PI3Kδ Inhibition of 2‑((6-Amino‑9H‑purin-9-yl)methyl)-5-methyl-3‑(o‑tolyl)quinazolin-4(3H)‑one (IC87114) and Its Conformatio... von Lodola, Alessio, Bertolini, Serena, Biagetti, Matteo, Capacchi, Silvia, Facchinetti, Fabrizio, Gallo, Paola Maria, Pappani, Alice, Mor, Marco, Pala, Daniele, Rivara, Silvia, Visentini, Filippo, Corsi, Mauro, Capelli, Anna Maria

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Correction to Metadynamics Simulations Distinguish Short- and Long-Residence-Time Inhibitors of Cyclin-Dependent Kinase 8 von Callegari, Donatella, Lodola, Alessio, Pala, Daniele, Rivara, Silvia, Mor, Marco, Rizzi, Andrea, Capelli, Anna Maria

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Design, Synthesis, and Activity of a Novel Series of Pyridazine-Based ALK5 Inhibitors von Pala, Daniele, Ronchi, Paolo, Rescigno, Donatella, Bertani, Barbara, Capelli, Anna Maria, Guariento, Sara, Marchini, Gessica, Milioli, Marco, Cesari, Nicola, Federico, Giuseppina, Grandi, Andrea, Stellari, Franco F., Fernandez, Sergio Xanxo, Pappani, Alice, Venturi, Luca, Biagetti, Matteo, Civelli, Maurizio, Semeraro, Teresa, Bianchi, Federica, Trist, Iuni M. L., Remelli, Rosaria, Armani, Elisabetta, Pizzirani, Daniela

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1,2,4-Triazolyl Azabicyclo[3.1.0]hexanes: A New Series of Potent and Selective Dopamine D 3 Receptor Antagonists von Micheli, Fabrizio, Arista, Luca, Bonanomi, Giorgio, Blaney, Frank E., Braggio, Simone, Capelli, Anna Maria, Checchia, Anna, Damiani, Federica, Di-Fabio, Romano, Fontana, Stefano, Gentile, Gabriella, Griffante, Cristiana, Hamprecht, Dieter, Marchioro, Carla, Mugnaini, Manolo, Piner, Jacqui, Ratti, Emiliangelo, Tedesco, Giovanna, Tarsi, Luca, Terreni, Silvia, Worby, Angela, Ashby, Charles R., Heidbreder, Christian

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Stable expression and functional characterization of a human nicotinic acetylcholine receptor with α6β2 properties: discovery of selective antagonists von Capelli, Anna Maria, Castelletti, Laura, Chen, Yu Hua, Van der Keyl, Harjeet, Pucci, Luca, Oliosi, Beatrice, Salvagno, Cristian, Bertani, Barbara, Gotti, Cecilia, Powell, Andrew, Mugnaini, Manolo

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1,2,4-Triazol-3-yl-thiopropyl-tetrahydrobenzazepines:  A Series of Potent and Selective Dopamine D 3 Receptor Antagonists von Micheli, Fabrizio, Bonanomi, Giorgio, Blaney, Frank E., Braggio, Simone, Capelli, Anna Maria, Checchia, Anna, Curcuruto, Ornella, Damiani, Federica, Di Fabio, Romano, Donati, Daniele, Gentile, Gabriella, Gribble, Andy, Hamprecht, Dieter, Tedesco, Giovanna, Terreni, Silvia, Tarsi, Luca, Lightfoot, Andrew, Stemp, Geoff, MacDonald, Gregor, Smith, Alex, Pecoraro, Michela, Petrone, Marcella, Perini, Ornella, Piner, Jacqui, Rossi, Tino, Worby, Angela, Pilla, Maria, Valerio, Enzo, Griffante, Cristiana, Mugnaini, Manolo, Wood, Martyn, Scott, Claire, Andreoli, Michela, Lacroix, Laurent, Schwarz, Adam, Gozzi, Alessandro, Bifone, Angelo, Ashby, Charles R., Hagan, Jim J., Heidbreder, Christian

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