Search filters

List of works by Steven O Nielsen

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

scientific article published on 01 July 2013

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

scientific article published on 01 February 2010

Adaptive multiscale molecular dynamics of macromolecular fluids

scientific article published on 3 December 2010

Coarse-grained potential models for phenyl-based molecules: I. Parametrization using experimental data

scientific article

Coarse-grained potential models for phenyl-based molecules: II. Application to fullerenes.

scientific article published in May 2010

Computational and Experimental Studies on the Effects of Monomer Planarity on Covalent Organic Framework Formation

scientific article

Contribution of fluorophore dynamics and solvation to resonant energy transfer in protein-DNA complexes: a molecular-dynamics study

scientific article

Dissipative particle dynamics simulations of polymersomes

scientific article published on 01 September 2005

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

scientific article published in May 2007

Gemini surfactants at the air/water interface: a fully atomistic molecular dynamics study

scientific article published on 01 November 2006

Hydrophilic directional slippery rough surfaces for water harvesting.

scientific article published on 30 March 2018

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

scientific article published in September 2005

Investigation of Controlled Growth of Metal-Organic Frameworks on Anisotropic Virus Particles.

scientific article published on 19 March 2018

Modeling surfactant adsorption on hydrophobic surfaces

scientific article published on 08 June 2005

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

scientific article published on 15 June 2012

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

scientific article published on 11 July 2017

Molecular dynamics simulations of surfactant self-organization at a solid-liquid interface

scientific article published on 01 January 2006

Molecular dynamics study of a nanotube-binding amphiphilic helical peptide at different water/hydrophobic interfaces.

scientific article published on December 2008

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

scientific article published in September 2013

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

scientific article published in October 2015

Non-Arrhenius Reaction-Diffusion Kinetics for Protein Inactivation over a Large Temperature Range

scientific article published on 31 July 2019

Parametrization and application of a coarse grained force field for benzene/fullerene interactions with lipids.

scientific article published on 19 November 2010

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

scientific article

Recent progress in adaptive multiscale molecular dynamics simulations of soft matter.

scientific article published on 24 August 2010

Role of peptide--peptide interactions in stabilizing peptide-wrapped single-walled carbon nanotubes: a molecular dynamics study.

scientific article published in January 2009

Self-assembling cyclic peptides: molecular dynamics studies of dimers in polar and nonpolar solvents

scientific article published on 01 September 2006

Site-Selective Nucleation and Size Control of Gold Nanoparticle Photothermal Antennae on the Pore Structures of a Virus

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

scientific article published on 01 December 2009

Supramolecular and biomacromolecular enhancement of metal-free magnetic resonance imaging contrast agents

scientific article published on 05 February 2020

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

scientific article published on 24 October 2019

Transmembrane peptide-induced lipid sorting and mechanism of Lalpha-to-inverted phase transition using coarse-grain molecular dynamics.

scientific article

Unfolding a linker between helical repeats

scientific article published on 15 April 2005