Efficient conformational sampling and weak scoring in docking programs? Strategy of the wisdom of crowds

por Chaput, Ludovic, Mouawad, Liliane
Publicado 2017

ASC-G4, an algorithm to calculate advanced structural characteristics of G-quadruplexes

por Farag, Marc, Messaoudi, Cédric, Mouawad, Liliane
Publicado 2023

Benchmark of four popular virtual screening programs: construction of the active/decoy dataset remains a major determinant of measured performance

por Chaput, Ludovic, Martinez-Sanz, Juan, Saettel, Nicolas, Mouawad, Liliane
Publicado 2016

Deciphering the Mechanism of Inhibition of SERCA1a by Sarcolipin Using Molecular Simulations

por Barbot, Thomas, Beswick, Veronica, Montigny, Cédric, Quiniou, Éric, Jamin, Nadège, Mouawad, Liliane
Publicado 2021

Corrigendum: Deciphering the mechanism of inhibition of SERCA1a by sarcolipin using molecular simulations

por Barbot, Thomas, Beswick, Veronica, Montigny, Cédric, Quiniou, Éric, Jamin, Nadège, Mouawad, Liliane
Publicado 2022

Optimization of G‐Quadruplex Ligands through a SAR Study Combining Parallel Synthesis and Screening of Cationic Bis(acylhydrazones)

por Reznichenko, Oksana, Leclercq, Denis, Franco Pinto, Jaime, Mouawad, Liliane, Gabelica, Valérie, Granzhan, Anton
Publicado 2022

vSDC: a method to improve early recognition in virtual screening when limited experimental resources are available

por Chaput, Ludovic, Martinez-Sanz, Juan, Quiniou, Eric, Rigolet, Pascal, Saettel, Nicolas, Mouawad, Liliane
Publicado 2016

Structure-based mutational analysis of ICAT residues mediating negative regulation of β-catenin co-transcriptional activity

por Domingues, Mélanie J., Martinez-Sanz, Juan, Papon, Laura, Larue, Lionel, Mouawad, Liliane, Bonaventure, Jacky
Publicado 2017