Optimization of 4‑Aminoquinoline/Clotrimazole-Based Hybrid Antimalarials: Further Structure–Activity Relationships, in Vivo Studies, and Preliminary Toxicity Profiling von Gemma, Sandra, Camodeca, Caterina, Sanna Coccone, Salvatore, Joshi, Bhupendra P, Bernetti, Matteo, Moretti, Vittoria, Brogi, Simone, Bonache de Marcos, Maria Cruz, Savini, Luisa, Taramelli, Donatella, Basilico, Nicoletta, Parapini, Silvia, Rottmann, Matthias, Brun, Reto, Lamponi, Stefania, Caccia, Silvio, Guiso, Giovanna, Summers, Robert L, E. Martin, Rowena, Saponara, Simona, Gorelli, Beatrice, Novellino, Ettore, Campiani, Giuseppe, Butini, Stefania

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Discovery of a New Class of Potential Multifunctional Atypical Antipsychotic Agents Targeting Dopamine D3 and Serotonin 5-HT1A and 5-HT2A Receptors: Design, Synthesis, and Effects... von Butini, Stefania, Gemma, Sandra, Campiani, Giuseppe, Franceschini, Silvia, Trotta, Francesco, Borriello, Marianna, Ceres, Nicoletta, Ros, Sindu, Coccone, Salvatore Sanna, Bernetti, Matteo, De Angelis, Meri, Brindisi, Margherita, Nacci, Vito, Fiorini, Isabella, Novellino, Ettore, Cagnotto, Alfredo, Mennini, Tiziana, Sandager-Nielsen, Karin, Andreasen, Jesper Tobias, Scheel-Kruger, Jorgen, Mikkelsen, Jens D, Fattorusso, Caterina

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Combining 4-Aminoquinoline- and Clotrimazole-Based Pharmacophores toward Innovative and Potent Hybrid Antimalarials von Gemma, Sandra, Campiani, Giuseppe, Butini, Stefania, Joshi, Bhupendra P, Kukreja, Gagan, Coccone, Salvatore Sanna, Bernetti, Matteo, Persico, Marco, Nacci, Vito, Fiorini, Isabella, Novellino, Ettore, Taramelli, Donatella, Basilico, Nicoletta, Parapini, Silvia, Yardley, Vanessa, Croft, Simon, Keller-Maerki, Sonja, Rottmann, Matthias, Brun, Reto, Coletta, Massimiliano, Marini, Stefano, Guiso, Giovanna, Caccia, Silvio, Fattorusso, Caterina

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Microwave-assisted synthesis of 4-quinolylhydrazines followed by nickel boride reduction: a convenient approach to 4-aminoquinolines and derivatives von Gemma, Sandra, Kukreja, Gagan, Tripaldi, Pierangela, Altarelli, Maria, Bernetti, Matteo, Franceschini, Silvia, Savini, Luisa, Campiani, Giuseppe, Fattorusso, Caterina, Butini, Stefania

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Development of piperazine-tethered heterodimers as potent antimalarials against chloroquine-resistant P. falciparum strains. Synthesis and molecular modeling von Gemma, Sandra, Kukreja, Gagan, Campiani, Giuseppe, Butini, Stefania, Bernetti, Matteo, Joshi, Bhupendra P., Savini, Luisa, Basilico, Nicoletta, Taramelli, Donatella, Yardley, Vanessa, Bertamino, Alessia, Novellino, Ettore, Persico, Marco, Catalanotti, Bruno, Fattorusso, Caterina

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Discovery of a New Class of Potential Multifunctional Atypical Antipsychotic Agents Targeting Dopamine D 3 and Serotonin 5-HT 1A and 5-HT 2A Receptors: Design, Synthesis, and Effec... von Butini, Stefania, Gemma, Sandra, Campiani, Giuseppe, Franceschini, Silvia, Trotta, Francesco, Borriello, Marianna, Ceres, Nicoletta, Ros, Sindu, Coccone, Salvatore Sanna, Bernetti, Matteo, De Angelis, Meri, Brindisi, Margherita, Nacci, Vito, Fiorini, Isabella, Novellino, Ettore, Cagnotto, Alfredo, Mennini, Tiziana, Sandager-Nielsen, Karin, Andreasen, Jesper Tobias, Scheel-Kruger, Jorgen, Mikkelsen, Jens D., Fattorusso, Caterina

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ChemInform Abstract: Microwave-Assisted Synthesis of 4-Quinolylhydrazines Followed by Nickel Boride Reduction: A Convenient Approach to 4-aminoquinolines and Derivatives von Gemma, Sandra, Kukreja, Gagan, Tripaldi, Pierangela, Altarelli, Maria, Bernetti, Matteo, Franceschini, Silvia, Savini, Luisa, Campiani, Giuseppe, Fattorusso, Caterina, Butini, Stefania

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NEUARTIGE ALS ANTI-MALARIA-WIRKSTOFFE VERWENDBARE 4-AMINO-CHINOLINDERIVATE von KUKREJA, GAGAN, FATTORUSSO, CATERINA, GEMMA, SANDRA, BUTINI, STEFANIA, JOSHI, BHUPENDRA, PERSICO, MARCO, BERNETTI, MATTEO, COCCONE, SALVATOR

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NOVEL 4-AMINO-QUINOLINE DERIVATIVES USEFUL AS ANTI-MALARIA DRUGS von KUKREJA, GAGAN, COCCONE, SALVATOR, SANNA, FATTORUSSO, CATERINA, GEMMA, SANDRA, BUTINI, STEFANIA, PERSICO, MARCO, BERNETTI, MATTEO, JOSHI, BHUPENDRA, PRASAD

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NOVEL 4-AMINO-QUINOLINE DERIVATIVES USEFUL AS ANTI-MALARIA DRUGS von CAMPIANI GIUSEPPE, GEMMA SANDRA, JOSHI BHUPENDRA PRASAD, KUKREJA GAGAN, FATTORUSSO CATERINA, PERSICO MARCO, COCCONE SALVATOR SANNA, BUTINI STEFANIA, BERNETTI MATTEO

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NOVEL 4-AMINO-QUINOLINE DERIVATIVES USEFUL AS ANTI-MALARIA DRUGS von KUKREJA, GAGAN, COCCONE, SALVATOR, SANNA, FATTORUSSO, CATERINA, GEMMA, SANDRA, BUTINI, STEFANIA, PERSICO, MARCO, BERNETTI, MATTEO, JOSHI, BHUPENDRA, PRASAD

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NOVEL 4-AMINO-QUINOLINE DERIVATIVES USEFUL AS ANTI-MALARIA DRUGS von CAMPIANI, GIUSEPPE, KUKREJA, GAGAN, COCCONE, SALVATOR, SANNA, FATTORUSSO, CATERINA, GEMMA, SANDRA, BUTINI, STEFANIA, PERSICO, MARCO, BERNETTI, MATTEO, JOSHI, BHUPENDRA, PRASAD

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Kinetics of Drug Binding and Residence Time von Bernetti, Mattia, Masetti, Matteo, Rocchia, Walter, Cavalli, Andrea

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Species distribution modelling to support forest management. A literature review von Pecchi, Matteo, Marchi, Maurizio, Burton, Vanessa, Giannetti, Francesca, Moriondo, Marco, Bernetti, Iacopo, Bindi, Marco, Chirici, Gherardo

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An Integrated Markov State Model and Path Metadynamics Approach To Characterize Drug Binding Processes von Bernetti, Mattia, Masetti, Matteo, Recanatini, Maurizio, Amaro, Rommie E, Cavalli, Andrea

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Data-Driven Molecular Dynamics: A Multifaceted Challenge von Bernetti, Mattia, Bertazzo, Martina, Masetti, Matteo

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Probing allosteric communication with combined molecular dynamics simulations and network analysis von Bernetti, Mattia, Bosio, Stefano, Bresciani, Veronica, Falchi, Federico, Masetti, Matteo

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Similarities and Differences in Ligand Binding to Protein and RNA Targets: The Case of Riboflavin von Bosio, Stefano, Bernetti, Mattia, Rocchia, Walter, Masetti, Matteo

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Promoting transparency and reproducibility in enhanced molecular simulations von Bonomi, Massimiliano, Bussi, Giovanni, Camilloni, Carlo, Tribello, Gareth A, Banáš, Pavel, Barducci, Alessandro, Bernetti, Mattia, Bolhuis, Peter G, Bottaro, Sandro, Branduardi, Davide, Capelli, Riccardo, Carloni, Paolo, Ceriotti, Michele, Cesari, Andrea, Chen, Haochuan, Chen, Wei, Colizzi, Francesco, De, Sandip, De La Pierre, Marco, Donadio, Davide, Drobot, Viktor, Ensing, Bernd, Ferguson, Andrew L, Filizola, Marta, Fraser, James S, Fu, Haohao, Gasparotto, Piero, Gervasio, Francesco Luigi, Giberti, Federico, Gil-Ley, Alejandro, Giorgino, Toni, Heller, Gabriella T, Hocky, Glen M, Iannuzzi, Marcella, Invernizzi, Michele, Jelfs, Kim E, Jussupow, Alexander, Kirilin, Evgeny, Laio, Alessandro, Limongelli, Vittorio, Lindorff-Larsen, Kresten, Löhr, Thomas, Marinelli, Fabrizio, Martin-Samos, Layla, Masetti, Matteo, Meyer, Ralf, Michaelides, Angelos, Molteni, Carla, Morishita, Tetsuya, Nava, Marco, Paissoni, Cristina, Papaleo, Elena, Parrinello, Michele, Pfaendtner, Jim, Piaggi, Pablo, Piccini, GiovanniMaria, Pietropaolo, Adriana, Pietrucci, Fabio, Pipolo, Silvio, Provasi, Davide, Quigley, David, Raiteri, Paolo, Raniolo, Stefano, Rydzewski, Jakub, Salvalaglio, Matteo, Gabriele Cesare Sosso, Spiwok, Vojtěch, Šponer, Jiří, Swenson, David W H, Tiwary, Pratyush, Valsson, Omar, Vendruscolo, Michele, Voth, Gregory A, White, Andrew

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Enhanced Molecular Dynamics Simulations of Intrinsically Disordered Proteins von Masetti, Matteo, Bernetti, Mattia, Cavalli, Andrea

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