Combined Modeling and Biophysical Characterisation of CO₂ Interaction with Class II Hydrophobins: New Insight into the Mechanism Underpinning Primary GushingDECKERS, Sylvie M; VENKEN, Tom; VERACHTERT, Hubert et al.Journal of the American Society of Brewing Chemists. 2012, Vol 70, Num 4, pp 249-256, issn 0361-0470, 8 p.Article

Crystal instability in nanocrystalline materialsZHENG, Guang-Ping; MO LI.Acta materialia. 2007, Vol 55, Num 16, pp 5464-5472, issn 1359-6454, 9 p.Article

Synthesis, screening and computational investigation of pentacycloundecane-peptoids as potent CSA-HIV PR inhibitorsMAKATINI, MayaM; PETZOL, Katja; ARVIDSSON, Per I et al.European journal of medicinal chemistry. 2012, Vol 57, pp 459-467, issn 0223-5234, 9 p.Article

Reversible―irreversible plasticity transition in twinned copper nanopillarsBROWN, J. A; GHONIEM, N. M.Acta materialia. 2010, Vol 58, Num 3, pp 886-894, issn 1359-6454, 9 p.Article

Deformation and fracture of soda-lime-silica glass under tension by molecular dynamics simulation : Fracture and related phenomena of glassesTANIGUCHI, Taketoshi; ITO, Setsuro.Nippon seramikkusu kyokai gakujutsu ronbunshi. 2008, Vol 116, Num 8, pp 885-889, issn 0914-5400, 5 p.Conference Paper

MD simulation of cluster ejection due to sputtering by polyatomic projectilesMURAMOTO, T; YAMAMURA, Y.Applied surface science. 2003, Vol 203-04, pp 143-147, issn 0169-4332, 5 p.Conference Paper

Molecular Dynamics Study of Flexo-Electric Effect in the Banana-Shaped Gay-Berne SystemMIYAZAKI, Toshikuni; YAMASHITA, Mamoru.Ferroelectrics (Print). 2008, Vol 365, pp 115-121, issn 0015-0193, 7 p.Conference Paper

Structural, energetic and electrical properties of boron nitride nanotubes interacting with DMMP chemical agentDARVISH GANJI, M; GHOLIAN, M; MOHAMMADZADEH, S et al.Applied surface science. 2014, Vol 314, pp 575-580, issn 0169-4332, 6 p.Article

Footprints of plastic deformation in nanocrystalline metalsVAN SWYGENHOVEN, H.Materials science & engineering. A, Structural materials : properties, microstructure and processing. 2008, Vol 483-84, pp 33-39, issn 0921-5093, 7 p.Conference Paper

Influence of isomorphous substitution in MFI-type materials on the diffusion of n-hexane : Molecular dynamic studiesWLOCH, J.Applied surface science. 2007, Vol 253, Num 13, pp 5692-5695, issn 0169-4332, 4 p.Conference Paper

Structure and thermal properties of supported catalyst clusters for single-walled carbon nanotube growthFENG DING; BOLTON, Xim; ROSEN, Arne et al.Applied surface science. 2006, Vol 252, Num 15, pp 5254-5258, issn 0169-4332, 5 p.Conference Paper

Molecular dynamics simulation of Y-doped Σ37 grain boundary in aluminaJUN CHEN; LIZHI OUYANG; CHING, W. Y et al.Acta materialia. 2005, Vol 53, Num 15, pp 4111-4120, issn 1359-6454, 10 p.Article

Validation of the mechanism of cholesterol binding by StAR using short molecular dynamics simulationsBARBAR, Elie; LAVIGNE, Pierre; LEHOUX, Jean-Guy et al.Journal of steroid biochemistry and molecular biology. 2009, Vol 113, Num 1-2, pp 92-97, issn 0960-0760, 6 p.Article

Molecular rheology of perfluoropolyether lubricant via nonequilibrium molecular dynamics simulationHYOUNG JIN CHOI; QIAN GUO; CHUNG, Pil S et al.IEEE transactions on magnetics. 2007, Vol 43, Num 2, pp 903-905, issn 0018-9464, 3 p., 2Conference Paper

Hydration repulsion between membranes and polar surfaces: Simulation approaches versus continuum theoriesKANDUC, Matej; SCHLAICH, Alexander; SCHNECK, Emanuel et al.Advances in colloid and interface science (Print). 2014, Vol 208, pp 142-152, issn 0001-8686, 11 p.Article

Structure and motion of junctions between coherent and incoherent twin boundaries in copperBROWN, J. A; GHONIEM, N. M.Acta materialia. 2009, Vol 57, Num 15, pp 4454-4462, issn 1359-6454, 9 p.Article

Laser ablation of metals by femtosecond pulses : Theoretical and experimental studyNEDIALKOV, N. N; ATANASOV, P. A; AMORUSO, S et al.Applied surface science. 2007, Vol 253, Num 19, pp 7761-7766, issn 0169-4332, 6 p.Conference Paper

Comparing calculated and measured grain boundary energies in nickelROHRER, Gregory S; HOLM, Elizabeth A; ROLLETT, Anthony D et al.Acta materialia. 2010, Vol 58, Num 15, pp 5063-5069, issn 1359-6454, 7 p.Article

Stick―slip dynamics of coherent twin boundaries in copperQIYANG HU; LAN LI; GHONIEM, N. M et al.Acta materialia. 2009, Vol 57, Num 16, pp 4866-4873, issn 1359-6454, 8 p.Article

Micromechanics of tensile twinning in magnesium gleaned from molecular dynamics simulationsAGHABABAEI, Ramin; JOSHI, Shailendra P.Acta materialia. 2014, Vol 69, pp 326-342, issn 1359-6454, 17 p.Article

Can a carbon nano-coating resist metallic phase transformation in silicon substrate during nanoimpact?GOEL, Saurav; AGRAWAL, Anupam; FAISAL, Nadimul Haque et al.Wear. 2014, Vol 315, Num 1-2, pp 38-41, issn 0043-1648, 4 p.Article

Layer size effect on the shock compression behavior of fcc-bcc nanolaminatesZHANG, R. F; GERMANN, T. C; LIU, X.-Y et al.Acta materialia. 2014, Vol 79, pp 74-83, issn 1359-6454, 10 p.Article

Molecular dynamics simulation of collapsing phase for a sonoluminescing gas bubble in sulfuric acid solutions : A comparative study with theoretical resultsKIM, Ki Young; KWAK, Ho-Young; KIM, Jong Hyun et al.Journal of the Physical Society of Japan. 2007, Vol 76, Num 2, issn 0031-9015, 024301.1-024301.11Article

Melting behavior of nanosized lead particles embedded in an aluminum matrixZHAN SHI; WYNBLATT, Paul; SRINIVASAN, S. G et al.Acta materialia. 2004, Vol 52, Num 8, pp 2305-2316, issn 1359-6454, 12 p.Article

Molecular SIMS for organic layers: new insightsBERTRAND, P; DELCORTE, A; GARRISON, B. J et al.Applied surface science. 2003, Vol 203-04, pp 160-165, issn 0169-4332, 6 p.Conference Paper