Exponential consensus ranking improves the outcome in docking and receptor ensemble docking

por Palacio-Rodríguez, Karen, Lans, Isaias, Cavasotto, Claudio N., Cossio, Pilar
Publicado 2019

Flexi-pharma: a molecule-ranking strategy for virtual screening using pharmacophores from ligand-free conformational ensembles

por Lans, Isaias, Palacio-Rodríguez, Karen, Cavasotto, Claudio N., Cossio, Pilar
Publicado 2020

dockECR: Open consensus docking and ranking protocol for virtual screening of small molecules

por Ochoa, Rodrigo, Palacio-Rodriguez, Karen, Clemente, Camila M., Adler, Natalia S.
Publicado 2021

In silico discovery and biological validation of ligands of FAD synthase, a promising new antimicrobial target

por Lans, Isaias, Anoz-Carbonell, Ernesto, Palacio-Rodríguez, Karen, Aínsa, José Antonio, Medina, Milagros, Cossio, Pilar
Publicado 2020

A Bayesian approach to extracting free-energy profiles from cryo-electron microscopy experiments

por Giraldo-Barreto, Julian, Ortiz, Sebastian, Thiede, Erik H., Palacio-Rodriguez, Karen, Carpenter, Bob, Barnett, Alex H., Cossio, Pilar
Publicado 2021