Self-assembly of dipeptide sodium salts derived from alanine: a molecular dynamics study

Expanding the Solvent Chemical Space for Self-Assembly of Dipeptide Nanostructures

(2014) Thomas O. Mason et al.   ACS Nano

Insights into the Coassembly of Hydrogelators and Surfactants Based on Aromatic Peptide Amphiphiles

(2014) Scott Fleming et al.   BIOMACROMOLECULES

Molecular Dynamics Simulations of Sodium Dodecyl Sulfate Micelles in Water—The Effect of the Force Field

(2014) Xueming Tang et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Role of Hydrophobicity on Self-Assembly by Peptide Amphiphiles via Molecular Dynamics Simulations

(2014) Iris W. Fu et al.   LANGMUIR

Supramolecular Chirality: Solvent Chirality Transfer in Molecular Chemistry and Polymer Chemistry

(2014) Michiya Fujiki   Symmetry-Basel

Molecular Dynamics Simulations of Surface Hydration Layers Near Non-fouling Polymer Membranes

(2013) Heng Zhang et al.   ACTA CHIMICA SINICA

Structure and properties of the C-terminal β-helical domain of VgrG protein from Escherichia coli O157

(2013) Kazuya Uchida et al.   JOURNAL OF BIOCHEMISTRY

Molecular Dynamics Simulation and Computational Two-Dimensional Infrared Spectroscopic Study of Model Amyloid β-Peptide Oligomers

(2013) Jun Xu et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Solvent-Induced Handedness Inversion of Dipeptide Sodium Salts Derived from Alanine

(2013) Yi Li et al.   LANGMUIR

Terminal Is Important for the Helicity of the Self-Assemblies of Dipeptides Derived from Alanine

(2013) Yitai Fu et al.   LANGMUIR

Graphene-Induced Self-Assembly of Peptides into Macroscopic-Scale Organized Nanowire Arrays for Electrochemical NADH Sensing

(2013) Panpan Li et al.   LANGMUIR

Experimental and Computational Studies Reveal an Alternative Supramolecular Structure for Fmoc-Dipeptide Self-Assembly

(2012) Xiaojia Mu et al.   BIOMACROMOLECULES

Peptide Folding Problem: A Molecular Dynamics Study on Polyalanines Using Different Force Fields

(2012) Raffaele Raucci et al.   International Journal of Peptide Research and Therapeutics

Molecular Dynamics Simulations to Investigate the Structural Stability and Aggregation Behavior of the GGVVIA Oligomers Derived from Amyloid β Peptide

(2012) Liang-Kai Chang et al.   JOURNAL OF BIOMOLECULAR STRUCTURE & DYNAMICS

Polarizable Molecular Dynamics Simulations of Aqueous Dipeptides

(2012) Tugba G. Kucukkal et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Molecular Dynamics Simulation of Pyrene Solubilized in a Sodium Dodecyl Sulfate Micelle

(2012) Hui Yan et al.   LANGMUIR

Specific Interactions of Sodium Salts with Alanine Dipeptide and Tetrapeptide in Water: Insights from Molecular Dynamics

(2011) Filippos Ioannou et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Atomistic Molecular Dynamics Simulations of Peptide Amphiphile Self-Assembly into Cylindrical Nanofibers

(2011) One-Sun Lee et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Surface-Induced Self-Assembly of Dipeptides onto Nanotextured Surfaces

(2011) Gokhan Demirel et al.   LANGMUIR

Molecular Dynamics Study of the Effect of Calcium Ions on the Monolayer of SDC and SDSn Surfactants at the Vapor/Liquid Interface

(2011) Hui Yan et al.   LANGMUIR

Self-assembly of peptide amphiphiles: From molecules to nanostructures to biomaterials

(2010) Honggang Cui et al.   BIOPOLYMERS

Solvent-Induced Structural Transition of Self-Assembled Dipeptide: From Organogels to Microcrystals

(2010) Pengli Zhu et al.   CHEMISTRY-A EUROPEAN JOURNAL

Difference in Hydration between Carboxybetaine and Sulfobetaine

(2010) Qing Shao et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Direct Observation of Morphological Tranformation from Twisted Ribbons into Helical Ribbons

(2010) E. Thomas Pashuck et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Hydrogen Bonding and π-Stacking: How Reliable are Force Fields? A Critical Evaluation of Force Field Descriptions of Nonbonded Interactions

(2009) Robert S. Paton et al.   Journal of Chemical Information and Modeling

Efficient Energy Transfer within Self-Assembling Peptide Fibers: A Route to Light-Harvesting Nanomaterials

(2009) Kevin J. Channon et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Is Alanine Dipeptide a Good Model for Representing the Torsional Preferences of Protein Backbones?

(2008) Michael Feig   Journal of Chemical Theory and Computation

GROMACS 4:  Algorithms for Highly Efficient, Load-Balanced, and Scalable Molecular Simulation

(2008) Berk Hess et al.   Journal of Chemical Theory and Computation

Thermodynamic Origin of Hofmeister Ion Effects

(2008) Laurel M. Pegram et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Specific Ion Binding to Nonpolar Surface Patches of Proteins

(2008) Mikael Lund et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Molecular Simulation Studies of Protein Interactions with Zwitterionic Phosphorylcholine Self-Assembled Monolayers in the Presence of Water

(2008) Yi He et al.   LANGMUIR

Fmoc-Diphenylalanine Self Assembles to a Hydrogel via a Novel Architecture Based on π–π Interlocked β-Sheets

(2007) A. M. Smith et al.   ADVANCED MATERIALS