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A guiding potential method for evaluating the bending rigidity of tensionless lipid membranes from molecular simulation

The Journal of chemical physics, 2013-07, Vol.139 (3), p.034108-034108

2013

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Dissipative Particle Dynamics Simulations of Polymersomes

The journal of physical chemistry. B, 2005-09, Vol.109 (37), p.17708-17714

2005

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Free energy analysis of vesicle-to-bicelle transformation

Soft matter, 2011-01, Vol.7 (19), p.9012-9020

2011

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Effects of spherical fullerene nanoparticles on a dipalmitoyl phosphatidylcholine lipid monolayer: a coarse grain molecular dynamics approach

Soft matter, 2012-01, Vol.8 (37), p.9610-9616

2012

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Nested sampling in the canonical ensemble: direct calculation of the partition function from NVT trajectories

The Journal of chemical physics, 2013-09, Vol.139 (12), p.124104-124104

Nielsen, Steven O

2013

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Modifying the electronic properties of single-walled carbon nanotubes using designed surfactant peptides

Nanoscale, 2012-08, Vol.4 (15), p.4544-4554

2012

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Curvature and temperature-dependent thermal interface conductance between nanoscale gold and water

The Journal of chemical physics, 2022-08, Vol.157 (5), p.054703-054703

2022

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Transient Photoinactivation of Cell Membrane Protein Activity without Genetic Modification by Molecular Hyperthermia

ACS nano, 2019-11, Vol.13 (11), p.12487-12499

2019

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Molecular Hyperthermia: Spatiotemporal Protein Unfolding and Inactivation by Nanosecond Plasmonic Heating

Small (Weinheim an der Bergstrasse, Germany), 2017-09, Vol.13 (36), p.n/a

2017

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Recent progress in adaptive multiscale molecular dynamics simulations of soft matter

Physical chemistry chemical physics : PCCP, 2010-01, Vol.12 (39), p.1241-12414

2010

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Optical control of neuronal activities with photoswitchable nanovesicles

Nano research, 2023-01, Vol.16 (1), p.1033-1041

2023

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Adaptive multiscale molecular dynamics of macromolecular fluids

Physical review letters, 2010-12, Vol.105 (23), p.237802-237802, Article 237802

2010

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Nested sampling of isobaric phase space for the direct evaluation of the isothermal-isobaric partition function of atomic systems

The Journal of chemical physics, 2015-10, Vol.143 (15), p.154108-154108

2015

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Energy Conservation in Adaptive Hybrid Atomistic/Coarse-Grain Molecular Dynamics

Journal of chemical theory and computation, 2007-05, Vol.3 (3), p.1100-1105

2007

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A mean field approach for computing solid-liquid surface tension for nanoscale interfaces

The Journal of chemical physics, 2010-02, Vol.132 (5), p.054706-054706

2010

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Doping single-walled carbon nanotubes with surfactant peptides containing electron-donor substituents and nitrogen heterocycles

Carbon (New York), 2013-06, Vol.57, p.88-98

2013

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Molecular dynamics study of nanoparticles and non-ionic surfactant at an oil–water interface

Soft matter, 2011-01, Vol.7 (15), p.6942-6952

2011

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Towards an understanding of structure-nonlinearity relationships in triarylamine-based push-pull electro-optic chromophores: the influence of substituent and molecular conformation on molecular hyperpolarizabilities

Journal of materials chemistry. C, Materials for optical and electronic devices, 2014-01, Vol.2 (14), p.2591-2599

2014

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Computing free energies using nested sampling-based approaches

Molecular simulation, 2018-09, Vol.44 (13-14), p.1108-1123

2018

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Size-dependent hydrophobic to hydrophilic transition for nanoparticles:A molecular dynamics study

The Journal of chemical physics, 2009-12, Vol.131 (24), p.244706-244706-8

2009

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Probing Membrane Insertion Activity of Antimicrobial Polymers via Coarse-Grain Molecular Dynamics

Journal of chemical theory and computation, 2006-05, Vol.2 (3), p.649-655

2006

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Effect of Carboxylation on Carbon Nanotube Aqueous Dispersibility: A Predictive Coarse-Grained Molecular Dynamics Approach

Journal of physical chemistry. C, 2012-11, Vol.116 (43), p.23102-23106

2012

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Incorporating a hydrophobic solid into a coarse grain liquid framework: Graphite in an aqueous amphiphilic environment

The Journal of chemical physics, 2005-09, Vol.123 (12), p.124907-124907-9

2005

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Dicationic imidazolium-based dicarboxylate ionic liquids: Thermophysical properties and solubility

Journal of molecular liquids, 2020-06, Vol.308, p.112983, Article 112983

2020

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A guiding potential method for evaluating the bending rigidity of tensionless lipid membranes from molecular simulation

Dissipative Particle Dynamics Simulations of Polymersomes

Free energy analysis of vesicle-to-bicelle transformation

Effects of spherical fullerene nanoparticles on a dipalmitoyl phosphatidylcholine lipid monolayer: a coarse grain molecular dynamics approach

Nested sampling in the canonical ensemble: direct calculation of the partition function from NVT trajectories

Modifying the electronic properties of single-walled carbon nanotubes using designed surfactant peptides

Curvature and temperature-dependent thermal interface conductance between nanoscale gold and water

Transient Photoinactivation of Cell Membrane Protein Activity without Genetic Modification by Molecular Hyperthermia

Molecular Hyperthermia: Spatiotemporal Protein Unfolding and Inactivation by Nanosecond Plasmonic Heating

Recent progress in adaptive multiscale molecular dynamics simulations of soft matter

Optical control of neuronal activities with photoswitchable nanovesicles

Adaptive multiscale molecular dynamics of macromolecular fluids

Nested sampling of isobaric phase space for the direct evaluation of the isothermal-isobaric partition function of atomic systems

Energy Conservation in Adaptive Hybrid Atomistic/Coarse-Grain Molecular Dynamics

A mean field approach for computing solid-liquid surface tension for nanoscale interfaces

Doping single-walled carbon nanotubes with surfactant peptides containing electron-donor substituents and nitrogen heterocycles

Molecular dynamics study of nanoparticles and non-ionic surfactant at an oil–water interface

Towards an understanding of structure-nonlinearity relationships in triarylamine-based push-pull electro-optic chromophores: the influence of substituent and molecular conformation on molecular hyperpolarizabilities

Computing free energies using nested sampling-based approaches

Size-dependent hydrophobic to hydrophilic transition for nanoparticles:A molecular dynamics study

Probing Membrane Insertion Activity of Antimicrobial Polymers via Coarse-Grain Molecular Dynamics

Effect of Carboxylation on Carbon Nanotube Aqueous Dispersibility: A Predictive Coarse-Grained Molecular Dynamics Approach

Incorporating a hydrophobic solid into a coarse grain liquid framework: Graphite in an aqueous amphiphilic environment

Dicationic imidazolium-based dicarboxylate ionic liquids: Thermophysical properties and solubility

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