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Liliane Mouawad
Liliane Mouawad
Researcher in Molecular Simulation, Curie Institute
在 curie.fr 的电子邮件经过验证
标题
引用次数
引用次数
年份
Nucleosome chiral transition under positive torsional stress in single chromatin fibers
A Bancaud, G Wagner, NC e Silva, C Lavelle, H Wong, J Mozziconacci, ...
Molecular cell 27 (1), 135-147, 2007
1552007
Computation of low-frequency normal modes in macromolecules: improvements to the method of diagonalization in a mixed basis and application to hemoglobin
D Perahia, L Mouawad
Computers & chemistry 19 (3), 241-246, 1995
1311995
Motions in hemoglobin studied by normal mode analysis and energy minimization: evidence for the existence of tertiary T-like, quaternary R-like intermediate structures
L Mouawad, D Perahia
Journal of molecular biology 258 (2), 393-410, 1996
1221996
Diagonalization in a mixed basis: A method to compute low‐frequency normal modes for large macromolecules
L Mouawad, D Perahia
Biopolymers: Original Research on Biomolecules 33 (4), 599-611, 1993
1101993
Benchmark of four popular virtual screening programs: construction of the active/decoy dataset remains a major determinant of measured performance
L Chaput, J Martinez-Sanz, N Saettel, L Mouawad
Journal of cheminformatics 8, 1-17, 2016
982016
How to choose relevant multiple receptor conformations for virtual screening: a test case of Cdk2 and normal mode analysis
O Sperandio, L Mouawad, E Pinto, BO Villoutreix, D Perahia, MA Miteva
European Biophysics Journal 39, 1365-1372, 2010
792010
New potent dual inhibitors of CK2 and Pim kinases: discovery and structural insights
M López‐Ramos, R Prudent, V Moucadel, CF Sautel, C Barette, ...
The FASEB Journal 24 (9), 3171-3185, 2010
752010
Analysis of the low frequency normal modes of the T-state of aspartate transcarbamylase
A Thomas, MJ Field, L Mouawad, D Perahia
Journal of molecular biology 257 (5), 1070-1087, 1996
711996
Flexibility and Plasticity of Human Centrin 2 Binding to the Xeroderma Pigmentosum Group C Protein (XPC) from Nuclear Excision Repair,
A Yang, S Miron, L Mouawad, P Duchambon, Y Blouquit, CT Craescu
Biochemistry 45 (11), 3653-3663, 2006
612006
Efficient conformational sampling and weak scoring in docking programs? Strategy of the wisdom of crowds
L Chaput, L Mouawad
Journal of cheminformatics 9, 1-18, 2017
602017
Do cardiotoxins possess a functional site? Structural and chemical modification studies reveal the functional site of the cardiotoxin from Naja nigricollis
A Menez, E Gatineau, C Roumestand, AL Harvey, L Mouawad, B Gilquin, ...
Biochimie 72 (8), 575-588, 1990
591990
New insights into the allosteric mechanism of human hemoglobin from molecular dynamics simulations
L Mouawad, D Perahia, CH Robert, C Guilbert
Biophysical journal 82 (6), 3224-3245, 2002
552002
A method to explore transition paths in macromolecules. Applications to hemoglobin and phosphoglycerate kinase
C Guilbert, D Perahia, L Mouawad
Computer Physics Communications 91 (1-3), 263-273, 1995
501995
Theoretical modeling of the heme group with a hybrid QM/MM method
JD Maréchal, G Barea, F Maseras, A Lledós, L Mouawad, D Perahia
Journal of Computational Chemistry 21 (4), 282-294, 2000
472000
Expanding the chemical diversity of CK2 inhibitors
R Prudent, V Moucadel, M López-Ramos, S Aci, B Laudet, L Mouawad, ...
Molecular and cellular biochemistry 316, 71-85, 2008
452008
Structure, dynamics and thermodynamics of the human centrin 2/hSfi1 complex
J Martinez-Sanz, F Kateb, L Assairi, Y Blouquit, G Bodenhausen, ...
Journal of molecular biology 395 (1), 191-204, 2010
402010
Low frequency motions in phosphoglycerate kinase. A normal mode analysis
C Guilbert, F Pecorari, D Perahia, L Mouawad
Chemical physics 204 (2-3), 327-336, 1996
351996
Internal cavities and ligand passageways in human hemoglobin characterized by molecular dynamics simulations
L Mouawad, JD Maréchal, D Perahia
Biochimica et Biophysica Acta (BBA)-General Subjects 1724 (3), 385-393, 2005
342005
Flagellar microtubule doublet assembly in vitro reveals a regulatory role of tubulin C-terminal tails
M Schmidt-Cernohorska, I Zhernov, E Steib, M Le Guennec, R Achek, ...
Science 363 (6424), 285-288, 2019
332019
Molecular dynamics of the FixJ receiver domain: movement of the β4–α4 loop correlates with the in and out flip of Phe101
P Roche, L Mouawad, D Perahia, JP Samama, D Kahn
Protein Science 11 (11), 2622-2630, 2002
282002
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