| Year |
Citation |
Score |
| 2020 |
Jay A, Huet C, Salles N, Gunde M, Martin-Samos L, Richard N, Landa G, Goiffon V, de Gironcoli S, Hemeryck A, Mousseau N. Finding reaction pathways and transition states: r-ARTn and d-ARTn as an efficient and versatile alternative to string approaches. Journal of Chemical Theory and Computation. PMID 32794748 DOI: 10.1021/Acs.Jctc.0C00541 |
0.348 |
|
| 2020 |
Gelin S, Champagne-Ruel A, Mousseau N. Enthalpy-entropy compensation of atomic diffusion originates from softening of low frequency phonons. Nature Communications. 11: 3977. PMID 32770040 DOI: 10.1038/S41467-020-17812-2 |
0.345 |
|
| 2020 |
Jarrin T, Jay A, Raine M, Mousseau N, Hemeryck A, Richard N. Simulation of Single Particle Displacement Damage in Si₁₋ₓGeₓ Alloys—Interaction of Primary Particles With the Material and Generation of the Damage Structure Ieee Transactions On Nuclear Science. 67: 1273-1283. DOI: 10.1109/Tns.2020.2970488 |
0.331 |
|
| 2020 |
Tian L, Fan Y, Li L, Mousseau N. Identifying flow defects in amorphous alloys using machine learning outlier detection methods Scripta Materialia. 186: 185-189. DOI: 10.1016/J.Scriptamat.2020.05.038 |
0.305 |
|
| 2020 |
Moitzi F, Şopu D, Holec D, Perera D, Mousseau N, Eckert J. Chemical bonding effects on the brittle-to-ductile transition in metallic glasses Acta Materialia. 188: 273-281. DOI: 10.1016/J.Actamat.2020.02.002 |
0.363 |
|
| 2019 |
Zhou X, Mousseau N, Song J. Is Hydrogen Diffusion along Grain Boundaries Fast or Slow? Atomistic Origin and Mechanistic Modeling. Physical Review Letters. 122: 215501. PMID 31283335 DOI: 10.1103/Physrevlett.122.215501 |
0.314 |
|
| 2019 |
Eliassen SNH, Friis J, Ringdalen IG, Mousseau N, Trochet M, Li Y. Atomistic approach to simulate kink migration and kink-pair formation in silicon: The kinetic activation-relaxation technique Physical Review B. 100. DOI: 10.1103/Physrevb.100.155305 |
0.368 |
|
| 2019 |
Tian L, Li L, Ding J, Mousseau N. ART_data_analyzer: Automating parallelized computations to study the evolution of materials Softwarex. 9: 238-243. DOI: 10.1016/J.Softx.2019.03.002 |
0.377 |
|
| 2018 |
Candela R, Mousseau N, Veiga R, Domain C, Becquart C. Interaction between interstitial carbon atoms and an ½ 〈111〉 SIA loop in an iron matrix: a combined DFT, off lattice KMC and MD study. Journal of Physics. Condensed Matter : An Institute of Physics Journal. PMID 29989564 DOI: 10.1088/1361-648X/Aad25D |
0.338 |
|
| 2018 |
Bouzakraoui S, Mousseau N. Structural and thermodynamical properties of early human amylin oligomers using replica exchange molecular dynamics: mutation effect of three key residues F15, H18 and F23. Physical Chemistry Chemical Physics : Pccp. 19: 31290-31299. PMID 29148557 DOI: 10.1039/C7Cp06463B |
0.346 |
|
| 2018 |
Jay A, Hemeryck A, Richard N, Martin-Samos L, Raine M, Le Roch A, Mousseau N, Goiffon V, Paillet P, Gaillardin M, Magnan P. Simulation of Single-Particle Displacement Damage in Silicon—Part III: First Principle Characterization of Defect Properties Ieee Transactions On Nuclear Science. 65: 724-731. DOI: 10.1109/Tns.2018.2790843 |
0.361 |
|
| 2018 |
Mahmoud S, Mousseau N. Long-time point defect diffusion in ordered nickel-based binary alloys: How small kinetic differences can lead to completely long-time structural evolution Materialia. 4: 575-584. DOI: 10.1016/J.Mtla.2018.11.013 |
0.413 |
|
| 2018 |
Mahmoud S, Trochet M, Restrepo OA, Mousseau N. Study of point defects diffusion in nickel using kinetic activation-relaxation technique Acta Materialia. 144: 679-690. DOI: 10.1016/J.Actamat.2017.11.021 |
0.444 |
|
| 2017 |
Trochet M, Sauvé-Lacoursière A, Mousseau N. Algorithmic developments of the kinetic activation-relaxation technique: Accessing long-time kinetics of larger and more complex systems. The Journal of Chemical Physics. 147: 152712. PMID 29055330 DOI: 10.1063/1.4995426 |
0.453 |
|
| 2017 |
Salles N, Richard N, Mousseau N, Hemeryck A. Strain-driven diffusion process during silicon oxidation investigated by coupling density functional theory and activation relaxation technique. The Journal of Chemical Physics. 147: 054701. PMID 28789535 DOI: 10.1063/1.4996206 |
0.353 |
|
| 2017 |
Jay A, Raine M, Richard N, Mousseau N, Goiffon V, Hemeryck A, Magnan P. Simulation of Single Particle Displacement Damage in Silicon–Part II: Generation and Long-Time Relaxation of Damage Structure Ieee Transactions On Nuclear Science. 64: 141-148. DOI: 10.1109/Tns.2016.2628089 |
0.406 |
|
| 2017 |
Trochet M, Mousseau N. Energy landscape and diffusion kinetics of lithiated silicon: A kinetic activation-relaxation technique study Physical Review B. 96. DOI: 10.1103/Physrevb.96.134118 |
0.366 |
|
| 2017 |
Restrepo OA, Becquart CS, El-Mellouhi F, Bouhali O, Mousseau N. Diffusion mechanisms of C in 100, 110 and 111 Fe surfaces studied using kinetic activation-relaxation technique Acta Materialia. 136: 303-314. DOI: 10.1016/J.Actamat.2017.07.009 |
0.337 |
|
| 2017 |
Bentria ET, N'tsouaglo GK, Becquart CS, Bouhali O, Mousseau N, El-Mellouhi F. The role of emerging grain boundary at iron surface, temperature and hydrogen on metal dusting initiation Acta Materialia. 135: 340-347. DOI: 10.1016/J.Actamat.2017.06.049 |
0.303 |
|
| 2016 |
Binette V, Côté S, Mousseau N. Free-Energy Landscape of the Amino-Terminal Fragment of Huntingtin in Aqueous Solution. Biophysical Journal. 110: 1075-88. PMID 26958885 DOI: 10.1016/J.Bpj.2016.01.015 |
0.341 |
|
| 2016 |
Chakrabarty A, Bouhali O, Mousseau N, Becquart CS, El-Mellouhi F. Insights on finite size effects in ab initio study of CO adsorption and dissociation on Fe 110 surface Journal of Applied Physics. 120. DOI: 10.1063/1.4959990 |
0.311 |
|
| 2016 |
Rousseau B, Timoshevskii V, Mousseau N, Côté M, Zaghib K. Na3Fe2(SO4)2(SO3N) as a potential high capacity cathode material Materials Science and Engineering B: Solid-State Materials For Advanced Technology. 211: 185-190. DOI: 10.1016/J.Mseb.2016.07.007 |
0.3 |
|
| 2016 |
Restrepo OA, Mousseau N, El-Mellouhi F, Bouhali O, Trochet M, Becquart CS. Diffusion properties of Fe-C systems studied by using kinetic activation-relaxation technique Computational Materials Science. 112: 96-106. DOI: 10.1016/J.Commatsci.2015.10.017 |
0.409 |
|
| 2016 |
Sahputra IH, Chakrabarty A, Restrepo O, Bouhali O, Mousseau N, Becquart CS, El-Mellouhi F. Carbon adsorption on and diffusion through the Fe(110) surface and in bulk: Developing a new strategy for the use of empirical potentials in complex material set-ups Physica Status Solidi (B). 254: 1600408. DOI: 10.1002/Pssb.201600408 |
0.332 |
|
| 2015 |
N'Tsouaglo GK, Béland LK, Joly JF, Brommer P, Mousseau N, Pochet P. Probing Potential Energy Surface Exploration Strategies for Complex Systems. Journal of Chemical Theory and Computation. 11: 1970-7. PMID 26574398 DOI: 10.1021/Ct501032V |
0.751 |
|
| 2015 |
Nasica-Labouze J, Nguyen PH, Sterpone F, Berthoumieu O, Buchete NV, Coté S, De Simone A, Doig AJ, Faller P, Garcia A, Laio A, Li MS, Melchionna S, Mousseau N, Mu Y, et al. Amyloid β Protein and Alzheimer's Disease: When Computer Simulations Complement Experimental Studies. Chemical Reviews. 115: 3518-63. PMID 25789869 DOI: 10.1021/Cr500638N |
0.752 |
|
| 2015 |
Côté S, Binette V, Salnikov ES, Bechinger B, Mousseau N. Probing the Huntingtin 1-17 membrane anchor on a phospholipid bilayer by using all-atom simulations. Biophysical Journal. 108: 1187-98. PMID 25762330 DOI: 10.1016/J.Bpj.2015.02.001 |
0.312 |
|
| 2015 |
Trochet M, Béland LK, Joly JF, Brommer P, Mousseau N. Diffusion of point defects in crystalline silicon using the kinetic activation-relaxation technique method Physical Review B - Condensed Matter and Materials Physics. 91. DOI: 10.1103/Physrevb.91.224106 |
0.735 |
|
| 2015 |
Jain SK, Barkema GT, Mousseau N, Fang CM, Van Huis MA. Strong Long-Range Relaxations of Structural Defects in Graphene Simulated Using a New Semiempirical Potential Journal of Physical Chemistry C. 119: 9646-9655. DOI: 10.1021/Acs.Jpcc.5B01905 |
0.331 |
|
| 2015 |
Mousseau N, Béland LK, Brommer P, El-Mellouhi F, Joly JF, N'Tsouaglo GK, Restrepo O, Trochet M. Following atomistic kinetics on experimental timescales with the kinetic activation-relaxation technique Computational Materials Science. 100: 111-123. DOI: 10.1016/J.Commatsci.2014.11.047 |
0.735 |
|
| 2014 |
Sterpone F, Melchionna S, Tuffery P, Pasquali S, Mousseau N, Cragnolini T, Chebaro Y, St-Pierre JF, Kalimeri M, Barducci A, Laurin Y, Tek A, Baaden M, Nguyen PH, Derreumaux P. The OPEP protein model: from single molecules, amyloid formation, crowding and hydrodynamics to DNA/RNA systems. Chemical Society Reviews. 43: 4871-93. PMID 24759934 DOI: 10.1039/C4Cs00048J |
0.58 |
|
| 2014 |
Béland LK, Machado-Charry E, Pochet P, Mousseau N. Strain effects and intermixing at the Si surface: Importance of long-range elastic corrections in first-principles calculations Physical Review B - Condensed Matter and Materials Physics. 90. DOI: 10.1103/Physrevb.90.155302 |
0.718 |
|
| 2014 |
Brommer P, Béland LK, Joly JF, Mousseau N. Understanding long-time vacancy aggregation in iron: A kinetic activation-relaxation technique study Physical Review B - Condensed Matter and Materials Physics. 90. DOI: 10.1103/Physrevb.90.134109 |
0.77 |
|
| 2014 |
Cote S, Binette V, Salnikov ES, Bechinger B, Wei G, Mousseau N. Oligomerization of Huntingtin N-Terminal Fragment on a Phospholipid Bilayer Revealed by Molecular Dynamics Simulations Biophysical Journal. 106: 99a-100a. DOI: 10.1016/J.Bpj.2013.11.621 |
0.375 |
|
| 2013 |
Béland LK, Anahory Y, Smeets D, Guihard M, Brommer P, Joly JF, Pothier JC, Lewis LJ, Mousseau N, Schiettekatte F. Replenish and relax: explaining logarithmic annealing in ion-implanted c-Si. Physical Review Letters. 111: 105502. PMID 25166679 DOI: 10.1103/Physrevlett.111.105502 |
0.764 |
|
| 2013 |
Béland LK, Mousseau N. Long-time relaxation of ion-bombarded silicon studied with the kinetic activation-relaxation technique: Microscopic description of slow aging in a disordered system Physical Review B - Condensed Matter and Materials Physics. 88. DOI: 10.1103/Physrevb.88.214201 |
0.746 |
|
| 2013 |
Joly JF, Béland LK, Brommer P, Mousseau N. Contribution of vacancies to relaxation in amorphous materials: A kinetic activation-relaxation technique study Physical Review B - Condensed Matter and Materials Physics. 87. DOI: 10.1103/Physrevb.87.144204 |
0.778 |
|
| 2012 |
Nasica-Labouze J, Mousseau N. Kinetics of amyloid aggregation: a study of the GNNQQNY prion sequence. Plos Computational Biology. 8: e1002782. PMID 23209391 DOI: 10.1371/Journal.Pcbi.1002782 |
0.77 |
|
| 2012 |
Brommer P, Mousseau N. Comment on "Mechanism of void nucleation and growth in bcc Fe: atomistic simulations at experimental time scales". Physical Review Letters. 108: 219601; author reply. PMID 23003313 DOI: 10.1103/Physrevlett.108.219601 |
0.306 |
|
| 2012 |
Côté S, Wei G, Mousseau N. All-atom stability and oligomerization simulations of polyglutamine nanotubes with and without the 17-amino-acid N-terminal fragment of the Huntingtin protein. The Journal of Physical Chemistry. B. 116: 12168-79. PMID 22978784 DOI: 10.1021/Jp306661C |
0.373 |
|
| 2012 |
St-Pierre JF, Mousseau N. Large loop conformation sampling using the activation relaxation technique, ART-nouveau method. Proteins. 80: 1883-94. PMID 22488731 DOI: 10.1002/Prot.24085 |
0.576 |
|
| 2012 |
Côté S, Laghaei R, Derreumaux P, Mousseau N. Distinct dimerization for various alloforms of the amyloid-beta protein: Aβ(1-40), Aβ(1-42), and Aβ(1-40)(D23N). The Journal of Physical Chemistry. B. 116: 4043-55. PMID 22409719 DOI: 10.1021/Jp2126366 |
0.344 |
|
| 2012 |
St-Pierre JF, Bunker A, Róg T, Karttunen M, Mousseau N. Molecular dynamics simulations of the bacterial ABC transporter SAV1866 in the closed form. The Journal of Physical Chemistry. B. 116: 2934-42. PMID 22339391 DOI: 10.1021/Jp209126C |
0.581 |
|
| 2012 |
Chebaro Y, Jiang P, Zang T, Mu Y, Nguyen PH, Mousseau N, Derreumaux P. Structures of Aβ17-42 trimers in isolation and with five small-molecule drugs using a hierarchical computational procedure. The Journal of Physical Chemistry. B. 116: 8412-22. PMID 22283547 DOI: 10.1021/Jp2118778 |
0.344 |
|
| 2012 |
Dupuis L, Mousseau N. Understanding the EF-hand closing pathway using non-biased interatomic potentials. The Journal of Chemical Physics. 136: 035101. PMID 22280780 DOI: 10.1063/1.3671986 |
0.553 |
|
| 2012 |
Mousseau N, Béland LK, Brommer P, Joly J, El-Mellouhi F, Machado-Charry E, Marinica M, Pochet P. The Activation-Relaxation Technique: ART Nouveau and Kinetic ART Journal of Atomic, Molecular, and Optical Physics. 2012: 1-14. DOI: 10.1155/2012/925278 |
0.763 |
|
| 2012 |
Ganster P, Béland LK, Mousseau N. First stages of silicon oxidation with the activation relaxation technique Physical Review B - Condensed Matter and Materials Physics. 86. DOI: 10.1103/Physrevb.86.075408 |
0.716 |
|
| 2012 |
Dupuis L, Mousseau N. Holographic multiscale method used with non-biased atomistic forcefields for simulation of large transformations in protein Journal of Physics: Conference Series. 341. DOI: 10.1088/1742-6596/341/1/012015 |
0.531 |
|
| 2012 |
Cote S, Bouzakraoui S, Laghaei R, Wei G, Mousseau N. Multiscale Simulation of Polyglutamine and the Effect of Neighboring Amino Acids on Oligomerization Biophysical Journal. 102: 733a. DOI: 10.1016/J.Bpj.2011.11.3976 |
0.314 |
|
| 2011 |
Côté S, Derreumaux P, Mousseau N. Distinct Morphologies for Amyloid Beta Protein Monomer: Aβ1-40, Aβ1-42, and Aβ1-40(D23N). Journal of Chemical Theory and Computation. 7: 2584-92. PMID 26606631 DOI: 10.1021/Ct1006967 |
0.343 |
|
| 2011 |
St-Pierre JF, Karttunen M, Mousseau N, Róg T, Bunker A. Use of Umbrella Sampling to Calculate the Entrance/Exit Pathway for Z-Pro-Prolinal Inhibitor in Prolyl Oligopeptidase. Journal of Chemical Theory and Computation. 7: 1583-94. PMID 26596426 DOI: 10.1021/Ct1007058 |
0.581 |
|
| 2011 |
Béland LK, Brommer P, El-Mellouhi F, Joly JF, Mousseau N. Kinetic activation-relaxation technique. Physical Review. E, Statistical, Nonlinear, and Soft Matter Physics. 84: 046704. PMID 22181304 DOI: 10.1103/Physreve.84.046704 |
0.771 |
|
| 2011 |
Machado-Charry E, Béland LK, Caliste D, Genovese L, Deutsch T, Mousseau N, Pochet P. Optimized energy landscape exploration using the ab initio based activation-relaxation technique. The Journal of Chemical Physics. 135: 034102. PMID 21786982 DOI: 10.1063/1.3609924 |
0.726 |
|
| 2011 |
Nasica-Labouze J, Meli M, Derreumaux P, Colombo G, Mousseau N. A multiscale approach to characterize the early aggregation steps of the amyloid-forming peptide GNNQQNY from the yeast prion sup-35. Plos Computational Biology. 7: e1002051. PMID 21625573 DOI: 10.1371/Journal.Pcbi.1002051 |
0.791 |
|
| 2011 |
Laghaei R, Mousseau N, Wei G. Structure and thermodynamics of amylin dimer studied by Hamiltonian-temperature replica exchange molecular dynamics simulations. The Journal of Physical Chemistry. B. 115: 3146-54. PMID 21384830 DOI: 10.1021/Jp108870Q |
0.348 |
|
| 2011 |
Kerrache A, Mousseau N, Lewis LJ. Crystallization of amorphous silicon induced by mechanical shear deformations Physical Review B - Condensed Matter and Materials Physics. 84. DOI: 10.1103/Physrevb.84.014110 |
0.337 |
|
| 2011 |
Kerrache A, Mousseau N, Lewis LJ. Amorphous silicon under mechanical shear deformations: Shear velocity and temperature effects Physical Review B - Condensed Matter and Materials Physics. 83. DOI: 10.1103/Physrevb.83.134122 |
0.321 |
|
| 2011 |
Marinica MC, Willaime F, Mousseau N. Energy landscape of small clusters of self-interstitial dumbbells in iron Physical Review B - Condensed Matter and Materials Physics. 83. DOI: 10.1103/Physrevb.83.094119 |
0.355 |
|
| 2011 |
Lilianne D, Mousseau N. Unbiased Simulation of the Back and Forth Apo to Holo Conformations for the Calmodulin N-Terminal Nodule: A Sequence of Specific Events Biophysical Journal. 100: 534a. DOI: 10.1016/J.Bpj.2010.12.3114 |
0.335 |
|
| 2011 |
Côté S, Laghaei R, Derreumaux P, Mousseau N. Simulation of the Oligomerization Pathway for Different Alloforms of the Amyloid Beta Protein Related to Alzheimer's Disease Biophysical Journal. 100: 401a. DOI: 10.1016/J.Bpj.2010.12.2379 |
0.35 |
|
| 2011 |
St-Pierre J, Mousseau N. Loop Conformation Prediction through Saddle-Point Search Simulations using the Art Nouveau Method and OPEP Simplified Potential Biophysical Journal. 100: 217a. DOI: 10.1016/J.Bpj.2010.12.1396 |
0.598 |
|
| 2011 |
Nasica-Labouze J, Meli M, Derreumaux P, Colombo G, Mousseau N. Characterization of the Aggregation Pathway for a 20-mer of GNNQQNY using Coarse-Grained and All-Atom Representations Biophysical Journal. 100: 200a. DOI: 10.1016/J.Bpj.2010.12.1303 |
0.784 |
|
| 2010 |
Kallel H, Mousseau N, Schiettekatte F. Evolution of the potential-energy surface of amorphous silicon. Physical Review Letters. 105: 045503. PMID 20867860 DOI: 10.1103/Physrevlett.105.045503 |
0.364 |
|
| 2010 |
Laghaei R, Mousseau N. Spontaneous formation of polyglutamine nanotubes with molecular dynamics simulations. The Journal of Chemical Physics. 132: 165102. PMID 20441310 DOI: 10.1063/1.3383244 |
0.385 |
|
| 2010 |
Laghaei R, Mousseau N, Wei G. Effect of the disulfide bond on the monomeric structure of human amylin studied by combined Hamiltonian and temperature replica exchange molecular dynamics simulations. The Journal of Physical Chemistry. B. 114: 7071-7. PMID 20429571 DOI: 10.1021/Jp100205W |
0.359 |
|
| 2009 |
Chebaro Y, Mousseau N, Derreumaux P. Structures and thermodynamics of Alzheimer's amyloid-beta Abeta(16-35) monomer and dimer by replica exchange molecular dynamics simulations: implication for full-length Abeta fibrillation. The Journal of Physical Chemistry. B. 113: 7668-75. PMID 19415895 DOI: 10.1021/Jp900425E |
0.343 |
|
| 2009 |
Lu Y, Derreumaux P, Guo Z, Mousseau N, Wei G. Thermodynamics and dynamics of amyloid peptide oligomerization are sequence dependent. Proteins. 75: 954-63. PMID 19089954 DOI: 10.1002/Prot.22305 |
0.354 |
|
| 2009 |
Chebaro Y, Dong X, Laghaei R, Derreumaux P, Mousseau N. Replica exchange molecular dynamics simulations of coarse-grained proteins in implicit solvent. The Journal of Physical Chemistry. B. 113: 267-74. PMID 19067549 DOI: 10.1021/Jp805309E |
0.389 |
|
| 2008 |
Wei G, Song W, Derreumaux P, Mousseau N. Self-assembly of amyloid-forming peptides by molecular dynamics simulations. Frontiers in Bioscience : a Journal and Virtual Library. 13: 5681-92. PMID 18508615 DOI: 10.2741/3109 |
0.402 |
|
| 2008 |
Mousseau N, Derreumaux P. Exploring energy landscapes of protein folding and aggregation. Frontiers in Bioscience : a Journal and Virtual Library. 13: 4495-516. PMID 18508525 DOI: 10.2741/3019 |
0.414 |
|
| 2008 |
Dong X, Chen W, Mousseau N, Derreumaux P. Energy landscapes of the monomer and dimer of the Alzheimer's peptide Abeta(1-28). The Journal of Chemical Physics. 128: 125108. PMID 18376983 DOI: 10.1063/1.2890033 |
0.349 |
|
| 2008 |
Song W, Wei G, Mousseau N, Derreumaux P. Self-assembly of the beta2-microglobulin NHVTLSQ peptide using a coarse-grained protein model reveals a beta-barrel species. The Journal of Physical Chemistry. B. 112: 4410-8. PMID 18341325 DOI: 10.1021/Jp710592V |
0.307 |
|
| 2008 |
St-Pierre JF, Mousseau N, Derreumaux P. The complex folding pathways of protein A suggest a multiple-funnelled energy landscape. The Journal of Chemical Physics. 128: 045101. PMID 18248008 DOI: 10.1063/1.2812562 |
0.627 |
|
| 2008 |
Levasseur-Smith K, Mousseau N. Ab initio study of the diffusion mechanisms of gallium in a silicon matrix European Physical Journal B. 64: 165-172. DOI: 10.1140/Epjb/E2008-00296-4 |
0.365 |
|
| 2008 |
El-Mellouhi F, Mousseau N, Lewis LJ. Kinetic activation-relaxation technique: An off-lattice self-learning kinetic Monte Carlo algorithm Physical Review B - Condensed Matter and Materials Physics. 78. DOI: 10.1103/Physrevb.78.153202 |
0.429 |
|
| 2008 |
Levasseur-Smith K, Mousseau N. Numerical characterization of the Ga interstitial self-diffusion mechanisms in GaAs Journal of Applied Physics. 103. DOI: 10.1063/1.2936887 |
0.329 |
|
| 2007 |
Wei G, Mousseau N, Derreumaux P. Computational simulations of the early steps of protein aggregation. Prion. 1: 3-8. PMID 19164927 DOI: 10.4161/Pri.1.1.3969 |
0.36 |
|
| 2007 |
Yun MR, Mousseau N, Derreumaux P. Sampling small-scale and large-scale conformational changes in proteins and molecular complexes Journal of Chemical Physics. 126. PMID 17362087 DOI: 10.1063/1.2710270 |
0.335 |
|
| 2007 |
Melquiond A, Gelly JC, Mousseau N, Derreumaux P. Probing amyloid fibril formation of the NFGAIL peptide by computer simulations Journal of Chemical Physics. 126. PMID 17313247 DOI: 10.1063/1.2435358 |
0.392 |
|
| 2007 |
Derreumaux P, Mousseau N. Coarse-grained protein molecular dynamics simulations. The Journal of Chemical Physics. 126: 025101. PMID 17228975 DOI: 10.1063/1.2408414 |
0.423 |
|
| 2007 |
El-Mellouhi F, Mousseau N. Ab-initio simulations of self-diffusion mechanisms in semiconductors Physica B: Condensed Matter. 401: 658-661. DOI: 10.1016/J.Physb.2007.09.045 |
0.397 |
|
| 2007 |
El-Mellouhi F, Mousseau N. Ab initio characterization of arsenic vacancy diffusion pathways in GaAs with SIEST-A-RT Applied Physics a: Materials Science and Processing. 86: 309-312. DOI: 10.1007/S00339-006-3761-3 |
0.354 |
|
| 2006 |
Boucher G, Mousseau N, Derreumaux P. Aggregating the amyloid Abeta(11-25) peptide into a four-stranded beta-sheet structure. Proteins. 65: 877-88. PMID 17019697 DOI: 10.1002/Prot.21134 |
0.359 |
|
| 2006 |
Chen W, Mousseau N, Derreumaux P. The conformations of the amyloid-beta (21-30) fragment can be described by three families in solution. The Journal of Chemical Physics. 125: 084911. PMID 16965061 DOI: 10.1063/1.2337628 |
0.333 |
|
| 2006 |
Melquiond A, Mousseau N, Derreumaux P. Structures of soluble amyloid oligomers from computer simulations Proteins: Structure, Function and Genetics. 65: 180-191. PMID 16894607 DOI: 10.1002/Prot.21100 |
0.38 |
|
| 2006 |
Yun MR, Lavery R, Mousseau N, Zakrzewska K, Derreumaux P. ARTIST: an activated method in internal coordinate space for sampling protein energy landscapes. Proteins. 63: 967-75. PMID 16523485 DOI: 10.1002/Prot.20938 |
0.35 |
|
| 2006 |
El-Mellouhi F, Mousseau N. Charge-dependent migration pathways for the Ga vacancy in GaAs Physical Review B - Condensed Matter and Materials Physics. 74. DOI: 10.1103/Physrevb.74.205207 |
0.318 |
|
| 2006 |
El-Mellouhi F, Mousseau N. Thermally activated charge reversibility of gallium vacancies in GaAs Journal of Applied Physics. 100. DOI: 10.1063/1.2360770 |
0.303 |
|
| 2006 |
Chubynsky MV, Vocks H, Barkema GT, Mousseau N. Exploiting memory in event-based simulations Journal of Non-Crystalline Solids. 352: 4424-4429. DOI: 10.1016/J.Jnoncrysol.2006.01.117 |
0.359 |
|
| 2005 |
Vocks H, Chubynsky MV, Barkema GT, Mousseau N. Activated sampling in complex materials at finite temperature: the properly obeying probability activation-relaxation technique. The Journal of Chemical Physics. 123: 244707. PMID 16396563 DOI: 10.1063/1.2137693 |
0.401 |
|
| 2005 |
Mousseau N, Derreumaux P. Exploring the early steps of amyloid peptide aggregation by computers. Accounts of Chemical Research. 38: 885-91. PMID 16285711 DOI: 10.1021/Ar050045A |
0.368 |
|
| 2005 |
Mousseau N, Derreumaux P, Gilbert G. Navigation and analysis of the energy landscape of small proteins using the activation-relaxation technique. Physical Biology. 2: S101-7. PMID 16280615 DOI: 10.1088/1478-3975/2/4/S04 |
0.346 |
|
| 2005 |
Melquiond A, Boucher G, Mousseau N, Derreumaux P. Following the aggregation of amyloid-forming peptides by computer simulations Journal of Chemical Physics. 122. PMID 15910066 DOI: 10.1063/1.1886725 |
0.419 |
|
| 2005 |
El-Mellouhi F, Mousseau N. Self-vacancies in gallium arsenide: An ab initio calculation Physical Review B - Condensed Matter and Materials Physics. 71. DOI: 10.1103/Physrevb.71.125207 |
0.333 |
|
| 2005 |
Beaucage P, Mousseau N. Nucleation and crystallization process of silicon using the Stillinger-Weber potential Physical Review B - Condensed Matter and Materials Physics. 71. DOI: 10.1103/Physrevb.71.094102 |
0.331 |
|
| 2005 |
Mousseau N, Thorpe MF. Flexibility in biomolecules Physical Biology. 2. DOI: 10.1088/1478-3975/2/4/E01 |
0.369 |
|
| 2004 |
Wei G, Mousseau N, Derreumaux P. Sampling the self-assembly pathways of KFFE hexamers. Biophysical Journal. 87: 3648-56. PMID 15377527 DOI: 10.1529/Biophysj.104.047688 |
0.376 |
|
| 2004 |
Santini S, Mousseau N, Derreumaux P. In silico assembly of Alzheimer's Abeta16-22 peptide into beta-sheets. Journal of the American Chemical Society. 126: 11509-16. PMID 15366896 DOI: 10.1021/Ja047286I |
0.348 |
|
| 2004 |
Santini S, Wei G, Mousseau N, Derreumaux P. Pathway complexity of Alzheimer's beta-amyloid Abeta16-22 peptide assembly. Structure (London, England : 1993). 12: 1245-55. PMID 15242601 DOI: 10.1016/J.Str.2004.04.018 |
0.331 |
|
| 2004 |
Wei G, Mousseau N, Derreumaux P. Complex folding pathways in a simple beta-hairpin. Proteins. 56: 464-74. PMID 15229880 DOI: 10.1002/Prot.20127 |
0.392 |
|
| 2004 |
El-Mellouhi F, Mousseau N, Ordejón P. Sampling the diffusion paths of a neutral vacancy in silicon with quantum mechanical calculations Physical Review B - Condensed Matter and Materials Physics. 70. DOI: 10.1103/Physrevb.70.205202 |
0.364 |
|
| 2004 |
Drabold DA, Mousseau N. Michael F Thorpe Journal of Physics: Condensed Matter. 16. DOI: 10.1088/0953-8984/16/44/E01 |
0.53 |
|
| 2004 |
Mousseau N, Barkema GT. Binary continuous random networks Journal of Physics Condensed Matter. 16. DOI: 10.1088/0953-8984/16/44/015 |
0.346 |
|
| 2004 |
Wei G, Mousseau N, Derreumaux P. Exploring the early steps of aggregation of amyloid-forming peptide KFFE Journal of Physics Condensed Matter. 16. DOI: 10.1088/0953-8984/16/44/002 |
0.386 |
|
| 2003 |
Simdyankin SI, Mousseau N. Relationship between dynamical heterogeneities and stretched exponential relaxation. Physical Review. E, Statistical, Nonlinear, and Soft Matter Physics. 68: 041110. PMID 14682926 DOI: 10.1103/Physreve.68.041110 |
0.332 |
|
| 2003 |
Valiquette F, Mousseau N. Energy landscape of relaxed amorphous silicon Physical Review B - Condensed Matter and Materials Physics. 68: 1252091-1252098. DOI: 10.1103/Physrevb.68.125209 |
0.393 |
|
| 2003 |
Wei G, Derreumaux P, Mousseau N. Sampling the complex energy landscape of a simple β-hairpin Journal of Chemical Physics. 119: 6403-6406. DOI: 10.1063/1.1613642 |
0.325 |
|
| 2003 |
Mousseau N, Beaucage P, Valiquette F. Numerical Studies of the Dynamics of Silicon: Relaxation, Nucleation and Energy Landscape Materials Research Society Symposium - Proceedings. 762: 3-14. |
0.319 |
|
| 2002 |
Hunt ER, Gade PM, Mousseau N. Stretched-exponential dynamics in a chain of coupled chaotic oscillators Europhysics Letters. 60: 827-833. DOI: 10.1209/Epl/I2002-00291-Y |
0.317 |
|
| 2002 |
Nakhmanson SM, Drabold DA, Mousseau N. Comment on ``Boson peak in amorphous silicon: A numerical study'' Physical Review B. 66: 87201. DOI: 10.1103/Physrevb.66.087201 |
0.574 |
|
| 2002 |
Nakhmanson SM, Mousseau N. Crystallization study of model tetrahedral semiconductors Journal of Physics Condensed Matter. 14: 6627-6638. DOI: 10.1088/0953-8984/14/26/303 |
0.339 |
|
| 2002 |
Mousseau N, Barkema GT, Nakhmanson SM. Recent developments in the study of continuous random networks Philosophical Magazine B: Physics of Condensed Matter; Statistical Mechanics, Electronic, Optical and Magnetic Properties. 82: 171-183. DOI: 10.1080/13642810110084885 |
0.323 |
|
| 2002 |
Wei G, Mousseau N, Derreumaux P. Exploring the energy landscape of proteins: A characterization of the activation-relaxation technique Journal of Chemical Physics. 117: 11379-11387. DOI: 10.1063/1.1522373 |
0.37 |
|
| 2002 |
Nakhmanson SM, Drabold DA, Mousseau N. Comment on "Boson peak in amorphous silicon: A numerical study" Physical Review B - Condensed Matter and Materials Physics. 66: 872011-872012. |
0.52 |
|
| 2001 |
Mousseau N, Derreumaux P, Barkema GT, Malek R. Sampling activated mechanisms in proteins with the activation-relaxation technique Journal of Molecular Graphics and Modelling. 19: 78-86. PMID 11381533 DOI: 10.1016/S1093-3263(00)00134-0 |
0.43 |
|
| 2001 |
Loirat Y, Brébec G, Limoge Y, Mousseau N, Bocquet JL. Diffusion in Lennard-Jones glasses: Simulation studies of the activation parameters for collective mechanisms Defect and Diffusion Forum. 855-860. DOI: 10.4028/Www.Scientific.Net/Ddf.194-199.855 |
0.379 |
|
| 2001 |
Mousseau N. Simulating diffusion at low temperatures in binary Lennard-Jones glasses: The activation-relaxation technique Defect and Diffusion Forum. 775-788. DOI: 10.4028/Www.Scientific.Net/Ddf.194-199.775 |
0.428 |
|
| 2001 |
Malek R, Mousseau N, Barkema GT. Characterization of the activation-relaxation technique: Recent results on models of amorphous silicon Materials Research Society Symposium - Proceedings. 677. DOI: 10.1557/Proc-677-Aa8.4 |
0.384 |
|
| 2001 |
Barkema GT, Mousseau N, Vink RLC, Biswas P. Basic mechanisms of structural relaxation and diffusion in amorphous silicon Materials Research Society Symposium - Proceedings. 664. DOI: 10.1557/Proc-664-A28.1 |
0.415 |
|
| 2001 |
Biswas P, Barkema GT, Mousseau N, Van Der Weg WF. Efficient tight-binding Monte Carlo structural sampling of complex materials Europhysics Letters. 56: 427-433. DOI: 10.1209/Epl/I2001-00536-9 |
0.368 |
|
| 2001 |
Nakhmanson SM, Mousseau N, Barkema GT, Voyles PM, Drabold DA. Models of paracrystalline silicon with a defect-free bandgap International Journal of Modern Physics B. 15: 3253-3257. DOI: 10.1142/S0217979201007580 |
0.567 |
|
| 2001 |
Nakhmanson SM, Voyles PM, Mousseau N, Barkema GT, Drabold DA. Realistic models of paracrystalline silicon Physical Review B - Condensed Matter and Materials Physics. 63: 2352071-2352076. DOI: 10.1103/Physrevb.63.235207 |
0.566 |
|
| 2001 |
Mousseau N, Barkema GT. Fast bond-transposition algorithms for generating covalent amorphous structures Current Opinion in Solid State and Materials Science. 5: 497-502. DOI: 10.1016/S1359-0286(02)00005-0 |
0.314 |
|
| 2001 |
Barkema GT, Mousseau N. The activation-relaxation technique: An efficient algorithm for sampling energy landscapes Computational Materials Science. 20: 285-292. DOI: 10.1016/S0927-0256(00)00184-1 |
0.399 |
|
| 2001 |
Vink RLC, Barkema GT, Van der Weg WF, Mousseau N. Fitting the Stillinger-Weber potential to amorphous silicon Journal of Non-Crystalline Solids. 282: 248-255. DOI: 10.1016/S0022-3093(01)00342-8 |
0.335 |
|
| 2000 |
Barkema GT, Mousseau N. High-quality continuous random networks Physical Review B - Condensed Matter and Materials Physics. 62: 4985-4990. DOI: 10.1103/Physrevb.62.4985 |
0.332 |
|
| 2000 |
Song Y, Malek R, Mousseau N. Optimal activation and diffusion paths of perfect events in amorphous silicon Physical Review B - Condensed Matter and Materials Physics. 62: 15680-15685. DOI: 10.1103/Physrevb.62.15680 |
0.392 |
|
| 2000 |
Durandurdu M, Drabold DA, Mousseau N. Approximate ab initio calculations of electronic structure of amorphous silicon Physical Review B - Condensed Matter and Materials Physics. 62: 15307-15310. DOI: 10.1103/Physrevb.62.15307 |
0.552 |
|
| 2000 |
Mousseau N, Barkema GT. Activated mechanisms in amorphous silicon: An activation-relaxation-technique study Physical Review B - Condensed Matter and Materials Physics. 61: 1898-1906. DOI: 10.1103/Physrevb.61.1898 |
0.378 |
|
| 2000 |
Mousseau N, Barkema GT, De Leeuw SW. Elementary mechanisms governing the dynamics of silica Journal of Chemical Physics. 112: 960-964. DOI: 10.1063/1.480621 |
0.397 |
|
| 2000 |
Malek R, Mousseau N. Dynamics of Lennard-Jones clusters: A characterization of the activation-relaxation technique Physical Review E - Statistical Physics, Plasmas, Fluids, and Related Interdisciplinary Topics. 62: 7723-7728. DOI: 10.1016/S1093-3263(00)80117-5 |
0.372 |
|
| 2000 |
Mousseau N, Drabold DA. Numerical studies of the vibrational isocoordinate rule in chalcogenide glasses European Physical Journal B. 17: 667-671. DOI: 10.1007/S100510070106 |
0.515 |
|
| 1999 |
Mousseau N, Barkema G. Exploring high-dimensional energy landscapes Computing in Science & Engineering. 1: 74-80, 82. DOI: 10.1109/5992.753050 |
0.342 |
|
| 1999 |
Barkema GT, Mousseau N. Exploring structural mechanisms in disordered materials using the activation-relaxation technique Computer Physics Communications. 121: 206-209. DOI: 10.1016/S0010-4655(99)00314-8 |
0.361 |
|
| 1998 |
Barkema GT, Mousseau N. Identification of relaxation and diffusion mechanisms in amorphous silicon Physical Review Letters. 81: 1865-1868. DOI: 10.1103/Physrevlett.81.1865 |
0.393 |
|
| 1998 |
Mousseau N, Barkema GT. Traveling through potential energy landscapes of disordered materials: The activation-relaxation technique Physical Review E. 57: 2419-2424. DOI: 10.1103/Physreve.57.2419 |
0.371 |
|
| 1998 |
Boisvert G, Mousseau N, Lewis LJ. Surface diffusion coefficients by thermodynamic integration: Cu on Cu(100) Physical Review B - Condensed Matter and Materials Physics. 58: 12667-12670. DOI: 10.1103/Physrevb.58.12667 |
0.336 |
|
| 1998 |
Lewis LJ, Mousseau N. Tight-binding molecular-dynamics studies of defects and disorder in covalently bonded materials Computational Materials Science. 12: 210-241. DOI: 10.1016/S0927-0256(98)00030-5 |
0.358 |
|
| 1997 |
Lewis LJ, Mousseau N. Structural and Electronic Properties of a-Gaas: A Tight-Binding–Molecular-Dynamics–Art Simulation Mrs Proceedings. 491. DOI: 10.1557/Proc-491-463 |
0.37 |
|
| 1997 |
Mousseau N, Lewis LJ. Topology of amorphous tetrahedral semiconductors on intermediate length scales Physical Review Letters. 78: 1484-1487. DOI: 10.1103/Physrevlett.78.1484 |
0.384 |
|
| 1997 |
Mousseau N, Lewis LJ. Structural, electronic, and dynamical properties of amorphous gallium arsenide: A comparison between two topological models Physical Review B - Condensed Matter and Materials Physics. 56: 9461-9468. DOI: 10.1103/Physrevb.56.9461 |
0.365 |
|
| 1996 |
Barkema GT, Mousseau N. Event-based relaxation of continuous disordered systems Physical Review Letters. 77: 4358-4361. DOI: 10.1103/Physrevlett.77.4358 |
0.356 |
|
| 1993 |
Mousseau N, Thorpe MF. Structural model for crystalline and amorphous Si-Ge alloys Physical Review B. 48: 5172-5178. DOI: 10.1103/Physrevb.48.5172 |
0.331 |
|
| 1992 |
Mousseau N, Thorpe MF. Length mismatch in random semiconductor alloys. III. Crystalline and amorphous SiGe Physical Review B. 46: 15887-15893. DOI: 10.1103/Physrevb.46.15887 |
0.317 |
|
| 1989 |
Mousseau N, Lewis LJ. Computer-simulated model structures for hydrogenated amorphous semiconductors Journal of Non-Crystalline Solids. 114: 202-204. DOI: 10.1016/0022-3093(89)90113-0 |
0.332 |
|
| 1988 |
Lewis LJ, Mousseau N, Drolet F. Computer-Generated Structural Models for a-Si:H Mrs Proceedings. 141. DOI: 10.1557/Proc-141-71 |
0.341 |
|
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