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

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

Source: Frontiers in Pharmacology, Vol 14 (2023)

Subject Terms: in silico screening, coronavirus, COVID-19, protease, target-based, drug discovery, Therapeutics. Pharmacology, RM1-950

File Description: electronic resource

Relation: https://www.frontiersin.org/articles/10.3389/fphar.2023.1193282/full; https://doaj.org/toc/1663-9812

Access URL: https://doaj.org/article/37a7aaacc38c4e40801eaddd5b8743ba

Antitumor activity of new chemical compounds in triple negative mammary adenocarcinoma models

Authors: María V Giolito, Cristian M Camacho, Maitena Martinez-Amezaga, Carla I Traficante, Rocío A Giordano, Patricia G Cornier, Ernesto G Mata, Carina ML Delpiccolo, Dora B Boggián, Antonela Del Giúdice, Leandro E Mainetti, Olga G Scharovsky, Viviana R Rozados, María J Rico

Source: Future Science OA, Vol 6, Iss 3 (2020)

Subject Terms: antitumor effect, chemical agents, in vitro assays, triple negative mammary adenocarcinoma, Medicine, Medicine (General), R5-920

File Description: electronic resource

Relation: https://doaj.org/toc/2056-5623

Access URL: https://doaj.org/article/5bd3ca6cd32f400dba5952862076e5a1