In silico Guided Drug Repurposing: Discovery of New Competitive and Non-competitive Inhibitors of Falcipain-2

por Alberca, Lucas N., Chuguransky, Sara R., Álvarez, Cora L., Talevi, Alan, Salas-Sarduy, Emir
Publicado 2019

Cascade Ligand- and Structure-Based Virtual Screening to Identify New Trypanocidal Compounds Inhibiting Putrescine Uptake

por Alberca, Lucas N., Sbaraglini, María L., Morales, Juan F., Dietrich, Roque, Ruiz, María D., Pino Martínez, Agustina M., Miranda, Cristian G., Fraccaroli, Laura, Alba Soto, Catalina D., Carrillo, Carolina, Palestro, Pablo H., Talevi, Alan
Publicado 2018

Garbage in, garbage out: how reliable training data improved a virtual screening approach against SARS-CoV-2 MPro

por Ruatta, Santiago M., Prada Gori, Denis N., Fló Díaz, Martín, Lorenzelli, Franca, Perelmuter, Karen, Alberca, Lucas N., Bellera, Carolina L., Medeiros, Andrea, López, Gloria V., Ingold, Mariana, Porcal, Williams, Dibello, Estefanía, Ihnatenko, Irina, Kunick, Conrad, Incerti, Marcelo, Luzardo, Martín, Colobbio, Maximiliano, Ramos, Juan Carlos, Manta, Eduardo, Minini, Lucía, Lavaggi, María Laura, Hernández, Paola, Šarlauskas, Jonas, Huerta García, César Sebastian, Castillo, Rafael, Hernández-Campos, Alicia, Ribaudo, Giovanni, Zagotto, Giuseppe, Carlucci, Renzo, Medrán, Noelia S., Labadie, Guillermo R., Martinez-Amezaga, Maitena, Delpiccolo, Carina M. L., Mata, Ernesto G., Scarone, Laura, Posada, Laura, Serra, Gloria, Calogeropoulou, Theodora, Prousis, Kyriakos, Detsi, Anastasia, Cabrera, Mauricio, Alvarez, Guzmán, Aicardo, Adrián, Araújo, Verena, Chavarría, Cecilia, Mašič, Lucija Peterlin, Gantner, Melisa E., Llanos, Manuel A., Rodríguez, Santiago, Gavernet, Luciana, Park, Soonju, Heo, Jinyeong, Lee, Honggun, Paul Park, Kyu-Ho, Bollati-Fogolín, Mariela, Pritsch, Otto, Shum, David, Talevi, Alan, Comini, Marcelo A.
Publicado 2023