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Manipulation of small particles at solid liquid interface: light driven diffusioosmosis

Scientific reports, 2016-11, Vol.6 (1), p.36443-36443, Article 36443

2016

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Structure binding relationship of human surfactant protein D and various lipopolysaccharide inner core structures

Journal of structural biology, 2016-09, Vol.195 (3), p.387-395

2016

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Mixed quantum-classical Liouville molecular dynamics without momentum jump

The Journal of chemical physics, 2003-06, Vol.118 (23), p.10399-10406

2003

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New Insights into Lipid Monolayers from Coarse-Grained Simulation Techniques

Biophysical journal, 2014-09, Vol.107 (5), p.1038-1039

Santer, Mark

2014

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Photoswitchable precision glycooligomers and their lectin binding

Beilstein journal of organic chemistry, 2014-07, Vol.10 (1), p.1603-1612

2014

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Coarse-Grained Molecular Model for the Glycosylphosphatidylinositol Anchor with and without Protein

Journal of chemical theory and computation, 2020-06, Vol.16 (6), p.3889-3903

2020

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Quantum-classical Liouville description of multidimensional nonadiabatic molecular dynamics

The Journal of chemical physics, 2001-02, Vol.114 (5), p.2001-2012

2001

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The importance of side branches of glycosylphosphatidylinositol anchors: a molecular dynamics perspective

Glycobiology (Oxford), 2022-10, Vol.32 (11), p.933-948

2022

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A molecular dynamics model for glycosylphosphatidyl-inositol anchors: "flop down" or "lollipop"?

Physical chemistry chemical physics : PCCP, 2018-11, Vol.20 (46), p.29314-29324

2018

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Solvent-shared pairs of densely charged ions induce intense but short-range supra-additive slowdown of water rotation

Physical chemistry chemical physics : PCCP, 2016-01, Vol.18 (3), p.1918-1930

2016

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Cis-to-Trans Isomerization of Azobenzene Derivatives Studied with Transition Path Sampling and Quantum Mechanical/Molecular Mechanical Molecular Dynamics

Journal of chemical theory and computation, 2018-04, Vol.14 (4), p.2042-2051

2018

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Increasing the Affinity of an O‐Antigen Polysaccharide Binding Site in Shigella flexneri Bacteriophage Sf6 Tailspike Protein

Chemistry : a European journal, 2020-06, Vol.26 (32), p.7263-7273

2020

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Solvent-shared pairs of densely charged ions induce intense but short-range supra-additive slowdown of water rotationElectronic supplementary information (ESI) available: Full details of the parameterization of anion-cation interactions, density of the CsCl and MgSO4 solutions, dipole moment of sulfate as a function of the magnitude of the electric field from quantum mechanics calculations, fitting parameters and average reorientation times associated to the reorientation decay of water in CsCl

2016-01

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Conformational Diversity of O‑Antigen Polysaccharides of the Gram-Negative Bacterium Shigella flexneri Serotype Y

The journal of physical chemistry. B, 2014-03, Vol.118 (9), p.2523-2534

2014

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Solvent Networks Tune Thermodynamics of Oligosaccharide Complex Formation in an Extended Protein Binding Site

Journal of the American Chemical Society, 2018-08, Vol.140 (33), p.10447-10455

2018

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Photosensitive Peptidomimetic for Light-Controlled, Reversible DNA Compaction

Biomacromolecules, 2016-06, Vol.17 (6), p.1959-1968

2016

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Mechanical Compressibility of the Glycosylphosphatidylinositol (GPI) Anchor Backbone Governed by Independent Glycosidic Linkages

Journal of the American Chemical Society, 2012-11, Vol.134 (46), p.18964-18972

2012

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Bacteriophage Tailspikes and Bacterial O‑Antigens as a Model System to Study Weak-Affinity Protein–Polysaccharide Interactions

Journal of the American Chemical Society, 2016-07, Vol.138 (29), p.9109-9118

2016

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Subgel Phase Structure in Monolayers of Glycosylphosphatidylinositol Glycolipids

Angewandte Chemie (International ed.), 2012-12, Vol.51 (51), p.12874-12878

International ed. in English, 2012

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Dynamic capillary wetting studied with dissipative particle dynamics

New journal of physics, 2008-04, Vol.10 (4), p.043009

2008

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Leukocyte enrichment based on a modified pinched flow fractionation approach

Microfluidics and nanofluidics, 2013-03, Vol.14 (3-4), p.551-563

2013

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Continuum concepts in nanoscale capillary impregnation

New journal of physics, 2008-11, Vol.10 (11), p.113022

2008

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Versatility of a Glycosylphosphatidylinositol Fragment in Forming Highly Ordered Polymorphs

Langmuir, 2014-05, Vol.30 (18), p.5185-5192

2014

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Simulation of advanced microfluidic systems with dissipative particle dynamics

Microfluidics and nanofluidics, 2009-09, Vol.7 (3), p.307-323

2009

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Studies in Ecumenism and Ecclesiology in Honour of J. Robert Wright

Ecclesiology, 2008, Vol.4 (3), p.326-331

Santer, Mark

2008

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Manipulation of small particles at solid liquid interface: light driven diffusioosmosis

Structure binding relationship of human surfactant protein D and various lipopolysaccharide inner core structures

Mixed quantum-classical Liouville molecular dynamics without momentum jump

New Insights into Lipid Monolayers from Coarse-Grained Simulation Techniques

Photoswitchable precision glycooligomers and their lectin binding

Coarse-Grained Molecular Model for the Glycosylphosphatidylinositol Anchor with and without Protein

Quantum-classical Liouville description of multidimensional nonadiabatic molecular dynamics

The importance of side branches of glycosylphosphatidylinositol anchors: a molecular dynamics perspective

A molecular dynamics model for glycosylphosphatidyl-inositol anchors: "flop down" or "lollipop"?

Solvent-shared pairs of densely charged ions induce intense but short-range supra-additive slowdown of water rotation

Cis-to-Trans Isomerization of Azobenzene Derivatives Studied with Transition Path Sampling and Quantum Mechanical/Molecular Mechanical Molecular Dynamics

Increasing the Affinity of an O‐Antigen Polysaccharide Binding Site in Shigella flexneri Bacteriophage Sf6 Tailspike Protein

Conformational Diversity of O‑Antigen Polysaccharides of the Gram-Negative Bacterium Shigella flexneri Serotype Y

Solvent Networks Tune Thermodynamics of Oligosaccharide Complex Formation in an Extended Protein Binding Site

Photosensitive Peptidomimetic for Light-Controlled, Reversible DNA Compaction

Mechanical Compressibility of the Glycosylphosphatidylinositol (GPI) Anchor Backbone Governed by Independent Glycosidic Linkages

Bacteriophage Tailspikes and Bacterial O‑Antigens as a Model System to Study Weak-Affinity Protein–Polysaccharide Interactions

Subgel Phase Structure in Monolayers of Glycosylphosphatidylinositol Glycolipids

Dynamic capillary wetting studied with dissipative particle dynamics

Leukocyte enrichment based on a modified pinched flow fractionation approach

Continuum concepts in nanoscale capillary impregnation

Versatility of a Glycosylphosphatidylinositol Fragment in Forming Highly Ordered Polymorphs

Simulation of advanced microfluidic systems with dissipative particle dynamics

Studies in Ecumenism and Ecclesiology in Honour of J. Robert Wright

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