Chemistry and Modelling for Protein Recognition

Team Members

Liliane Mouawad

Liliane Mouawad

Liliane Mouawad Team Mahuteau-Betzer Inserm Researcher Tel: Back to the list

Key publications

Year of publication 2021

Thomas Barbot, Veronica Beswick, Cédric Montigny, Éric Quiniou, Nadège Jamin and Liliane Mouawad (2021 Feb 4)

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

Frontiers in Molecular Biosciences : 7 : 606254 : DOI : 10.3389/fmolb.2020.606254

Year of publication 2019

El Hassen Mokrani, Abderrahmane Bensegueni, Ludovic Chaput, Claire Beauvineau, Hanane Djeghim, Liliane Mouawad (2019 May 1)

Identification of New Potent Acetylcholinesterase Inhibitors Using Virtual Screening and In Vitro Approaches.

Molecular informatics : 38 : 1800118 : DOI : 10.1002/minf.201800118
M Schmidt-Cernohorska, I Zhernov, E Steib, M Le Guennec, R Achek, S Borgers, D Demurtas, L Mouawad, Z Lansky, V Hamel, P Guichard (2019 Jan 19)

Flagellar microtubule doublet assembly in vitro reveals a regulatory role of tubulin C-terminal tails.

Science (New York, N.Y.) : 363 : 285-288 : DOI : 10.1126/science.aav2567

Year of publication 2017

Chaput Ludovic, Mouawad Liliane (2017 Jun 12)

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

Journal of Cheminformatics : 9 : 37 : DOI : 10.1186/s13321-017-0227-x
Mélanie J Domingues, Juan Martinez-Sanz, Laura Papon, Lionel Larue, Liliane Mouawad, Jacky Bonaventure (2017 Mar 9)

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

PloS ONE : 12(3) : e0172603 : DOI : 10.1371/journal.pone.0172603

Year of publication 2016

Chaput L., Martinez-Sanz J., Saettel N., Mouawad L. (2016 Oct 17)

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

Journal of Cheminformatics : 8:56 : DOI : 10.1186/s13321-016-0167-x
Chaput L., Martinez-Sanz J., Quiniou E., Rigolet P., Saettel N., Mouawad L. (2016 Jan 18)

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

Journal of Cheminformatics : 8:1 : DOI : 10.1186/s13321-016-0112-z

Year of publication 2013

Eric Quiniou, Paul Guichard, David Perahia, Sergio Marco, Liliane Mouawad (2013 May 7)

An atomistic view of microtubule stabilization by GTP.

Structure (London, England : 1993) : 21 : 833-843 : DOI : 10.1016/j.str.2013.03.009

Year of publication 2009

Liliane Mouawad, Adriana Isvoran, Eric Quiniou, Constantin T Craescu (2009 Jan 22)

What determines the degree of compactness of a calcium-binding protein?

The FEBS journal : 276 : 1082-1093 : DOI : 10.1111/j.1742-4658.2008.06851.x