Publications by authors named "Alan Talevi"

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Tackling the issue of confined chemical space with AI-based de novo drug design and molecular optimization.
Alan Talevi, Lucas N Alberca, Carolina L Bellera

Expert Opin Drug Discov· November 2025

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Computer-Aided Discovery of Drugs Against Chagas Disease.
Carolina L Bellera, Lucas N Alberca, Alan Talevi

Methods Mol Biol· November 2025

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Cannabidiol combined with GABAergic drugs but not with sodium channel blockers prevents the development of drug-resistance seizures in a preclinical model.
Monserrat Fuentes-Mejia, Maximiliano J Fallico, Alan Talevi, Luciana Gavernet, Sandra A Orozco-Suárez

Front Pharmacol· October 2025

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Promising Prodiginins Biological Activities.
María F Ladetto, Melisa E Gantner, Boris E Rodenak-Kladniew, Santiago Rodriguez, María L Cuestas, Alan Talevi

Chem Biodivers· September 2025

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Mitigation of Acute Seizures and Neuropathology after Traumatic Brain Injury by Structure-Based Discovery-Identified Drugs.
Natallie Kajevu, Ivette Banuelos, Pedro Andrade, Elina Hämäläinen, Laureano Sabatier, Alan Talevi

J Neurotrauma· August 2025

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In silico screening to search for selective sodium channel blockers: When size matters.
Maximiliano José Fallico, Lucas Nicolás Alberca, Nicolás Enrique, Federico Orsi, Denis Nihuel Prada Gori, Alan Talevi

Brain Res· June 2025

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Discovery of Carbonic Anhydrase Inhibitors by a Combination of Ligand- and Structure-Based Virtual Screening.
Denis N Prada Gori, Emilia M Barrionuevo, Lucas N Alberca, María L Sbaraglini, Manuel A Llanos, Alan Talevi

J Chem Inf Model· May 2025

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Crystal Structure of Melphalan Hydrochloride and Its Association with Caffeine Improves Its Antineoplastic Action.
Juliana Pereira da Silva, Carin Cristina da Silva Batista, Maria Lúcia Schumacher, Santiago Rodriguez, Alan Talevi

ACS Omega· May 2025

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Drug-resistant epilepsy: Is there an overlooked association between drug resistant epilepsies and neuropsychiatric comorbidities?
Alan Talevi

Epilepsy Behav· December 2024

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An update on the novel methods for the discovery of antiseizure and antiepileptogenic medications: where are we in 2024?
Alan Talevi, Carolina Bellera

Expert Opin Drug Discov· August 2024

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In Silico Screening Identification of Fatty Acids and Fatty Acid Derivatives with Antiseizure Activity: In Vitro and In Vivo Validation.
Emilia Mercedes Barrionuevo, Estefanía Peralta, Agustín Manzur De Nardi, Juliana Monat, Maximiliano José Fallico, Alan Talevi

Pharmaceutics· July 2024

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Triclabendazole and clofazimine reduce replication and spermine uptake in vitro in Toxoplasma gondii.
Maria M Corvi, Franco Rossi, Agustina Ganuza, Andrés M Alonso, Lucas N Alberca, Alan Talevi

Parasitol Res· December 2023

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A Combined Ligand- and Structure-Based Virtual Screening To Identify Novel NaV1.2 Blockers: In Vitro Patch Clamp Validation and In Vivo Anticonvulsant Activity.
Manuel A Llanos, Nicolás Enrique, Vega Esteban-López, Sebastian Scioli-Montoto, David Sánchez-Benito, Alan Talevi

J Chem Inf Model· November 2023

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Computer-Aided Drug Discovery and Design: Recent Advances and Future Prospects.
Alan Talevi

Methods Mol Biol· September 2023

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Nanostructured lipid carriers containing benznidazole: physicochemical, biopharmaceutical and cellular in vitro studies.
Giuliana Muraca, María Esperanza Ruiz, Rocío C Gambaro, Sebastián Scioli-Montoto, María Laura Sbaraglini, Alan Talevi

Beilstein J Nanotechnol· July 2023

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Garbage in, garbage out: how reliable training data improved a virtual screening approach against SARS-CoV-2 MPro.
Santiago M Ruatta, Denis N Prada Gori, Martín Fló Díaz, Franca Lorenzelli, Karen Perelmuter, Alan Talevi

Front Pharmacol· June 2023

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Making the most effective use of available computational methods for drug repositioning.
Denis N Prada Gori, Lucas N Alberca, Alan Talevi

Expert Opin Drug Discov· May 2023

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Synthesis and biological evaluation of new antiseizure compounds derived from valproic acid.
Federico M Garofalo, María L Sbaraglini, Emilia M Barrionuevo, Estefanía Peralta, Evelyn L Bonifazi, Alan Talevi

Future Med Chem· May 2023

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A combined ligand and target-based virtual screening strategy to repurpose drugs as putrescine uptake inhibitors with trypanocidal activity.
Manuel A Llanos, Lucas N Alberca, María D Ruiz, María L Sbaraglini, Cristian Miranda, Alan Talevi

J Comput Aided Mol Des· February 2023

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Identification of New Carbonic Anhydrase VII Inhibitors by Structure-Based Virtual Screening.
Melisa E Gantner, Denis N Prada Gori, Manuel A Llanos, Alan Talevi, Andrea Angeli

J Chem Inf Model· October 2022

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Antiseizure medication discovery: Recent and future paradigm shifts.
Alan Talevi

Epilepsia Open· August 2022

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Novel Phenobarbital-Loaded Nanostructured Lipid Carriers for Epilepsy Treatment: From QbD to Evaluation.
Sebastian Scioli-Montoto, Maria Laura Sbaraglini, Jose Sebastian Cisneros, Cecilia Yamil Chain, Valeria Ferretti, Alan Talevi

Front Chem· August 2022

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iRaPCA and SOMoC: Development and Validation of Web Applications for New Approaches for the Clustering of Small Molecules.
Denis N Prada Gori, Manuel A Llanos, Carolina L Bellera, Alan Talevi, Lucas N Alberca

J Chem Inf Model· June 2022

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Structure-Based Virtual Screening Identifies Novobiocin, Montelukast, and Cinnarizine as TRPV1 Modulators with Anticonvulsant Activity .
Manuel A Llanos, Nicolás Enrique, María L Sbaraglini, Federico M Garofalo, Alan Talevi

J Chem Inf Model· June 2022

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Tetracycline Derivatives Inhibit Plasmodial Cysteine Protease Falcipain-2 through Binding to a Distal Allosteric Site.
Jorge Enrique Hernández González, Lucas N Alberca, Yordanka Masforrol González, Osvaldo Reyes Acosta, Alan Talevi

J Chem Inf Model· January 2022

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