Química Bioorgánica, Química Supramolecular y Modelización Molecular
University of Groningen
Groninga, HolandaPublicaciones en colaboración con investigadores/as de University of Groningen (16)
2008
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Water structuring and hydroxide ion binding at the interface between water and hydrophobic Walls of varying rigidity and van der Waals interactions
Journal of Physical Chemistry C, Vol. 112, Núm. 20, pp. 7689-7692
2005
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Characterization of the stereochemical selectivity of β-hairpin formation by molecular dynamics simulations
Journal of Physical Chemistry B, Vol. 109, Núm. 3, pp. 1281-1288
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Physisorption of hydroxide ions from aqueous solution to a hydrophobic surface
Journal of the American Chemical Society, Vol. 127, Núm. 7, pp. 2272-2276
2004
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Cooperative Dynamics in Two Dimensions
Physical Review Letters, Vol. 92, Núm. 3, pp. 355021-355024
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Cooperative Dynamics in Two Dimensions
Physical Review Letters, Vol. 92, Núm. 3, pp. 4
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Electrofreezing of confined water
Journal of Chemical Physics, Vol. 120, Núm. 15, pp. 7123-7130
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Instantaneous normal modes and cooperative dynamics in a quasi-two-dimensional system of particles
Journal of Physical Chemistry B, Vol. 108, Núm. 21, pp. 6856-6865
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Water confined to a slab geometry: A review of recent computer simulation studies
Journal of Physics Condensed Matter, Vol. 16, Núm. 45
2003
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Bilayer ice and alternate liquid phases of confined water
Journal of Chemical Physics, Vol. 119, Núm. 3, pp. 1694-1700
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Freezing transition and correlated motion in a quasi-two-dimensional colloid suspension
Physical Review E - Statistical Physics, Plasmas, Fluids, and Related Interdisciplinary Topics, Vol. 68, Núm. 6
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Freezing transition and correlated motion in a quasi-two-dimensional colloid suspension
Physical Review E - Statistical, Nonlinear, and Soft Matter Physics, Vol. 68, Núm. 6 1, pp. 615081-6150813
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Monolayer Ice
Physical Review Letters, Vol. 91, Núm. 2
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Sampling and convergence in free energy calculations of protein-ligand interactions: The binding of triphenoxypyridine derivatives to factor Xa and trypsin
Journal of Computer-Aided Molecular Design, Vol. 17, Núm. 10, pp. 673-686
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The effect of gauche molecular conformations on the phase diagram of a Langmuir monolayer
Langmuir, Vol. 19, Núm. 14, pp. 5949-5955
2002
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Molecular dynamics study of the folding of hydrophobin SC3 at a hydrophilic/hydrophobic interface
Biophysical Journal, Vol. 83, Núm. 1, pp. 112-124
2001
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Free energy barrier estimation of unfolding the α-helical surfactant-associated polypeptide c
Proteins: Structure, Function and Genetics, Vol. 43, Núm. 4, pp. 395-402