| Artigo em revista |
- Ashbaugh, Henry. "Nonpolar solute cononsolvency in ethanol/water mixtures – Connections to solvent structure". Journal
of Molecular Liquids (2020): http://dx.doi.org/10.1016/j.molliq.2019.111944.
10.1016/j.molliq.2019.111944
- Ashbaugh, Henry. "Emergence of non-monotonic deep cavity cavitand assembly with increasing portal methylation". Molecular
Systems Design & Engineering (2020): http://dx.doi.org/10.1039/c9me00076c.
10.1039/c9me00076c
- Ashbaugh, Henry. "Impact of Cyclic Block Copolymer Chain Architecture and Degree of Polymerization on Nanoscale Domain Spacing:
A Simulation and Scaling Theory Analysis". Macromolecules (2019): http://dx.doi.org/10.1021/acs.macromol.9b02015.
10.1021/acs.macromol.9b02015
- Ashbaugh, Henry. "Evaluation of second osmotic virial coefficients from molecular simulation following scaled-particle theory".
Molecular Simulation (2019): http://dx.doi.org/10.1080/08927022.2019.1639698.
10.1080/08927022.2019.1639698
- Ashbaugh, Henry. "Nanostructure stability and swelling of ternary block copolymer/homopolymer blends: A direct comparison
between dissipative particle dynamics and experiment". Journal of Polymer Science Part B: Polymer Physics (2019): http://dx.doi.org/10.1002/polb.24834.
10.1002/polb.24834
- Ashbaugh, Henry. "Electrostatic Control of Macrocyclization Reactions within Nanospaces". Journal of the American Chemical
Society (2019): http://dx.doi.org/10.1021/jacs.9b02287.
10.1021/jacs.9b02287
- Ashbaugh, Henry. "Methane Hydration-Shell Structure and Fragility". Angewandte Chemie International Edition (2018):
http://dx.doi.org/10.1002/anie.201809372.
10.1002/anie.201809372
- Ashbaugh, Henry. "Synthesis and Self-Assembly of Amphiphilic Star/Linear–Dendritic Polymers: Effect of Core versus Peripheral
Branching on Reverse Micelle Aggregation". Biomacromolecules (2018): http://dx.doi.org/10.1021/acs.biomac.8b00679.
10.1021/acs.biomac.8b00679
- Ashbaugh, Henry. "Connections between the Anomalous Volumetric Properties of Alcohols in Aqueous Solution and the Volume of
Hydrophobic Association". The Journal of Physical Chemistry B (2018): http://dx.doi.org/10.1021/acs.jpcb.7b08728.
10.1021/acs.jpcb.7b08728
- Ashbaugh, Henry. "Temperature-Dependent Hydrophobic Crossover Length Scale and Water Tetrahedral Order". The Journal of
Physical Chemistry Letters (2018): http://dx.doi.org/10.1021/acs.jpclett.7b03431.
10.1021/acs.jpclett.7b03431
- Ashbaugh, Henry. "The Thermodynamics of Anion Complexation to Nonpolar Pockets". The Journal of Physical Chemistry B
(2018): http://dx.doi.org/10.1021/acs.jpcb.7b12259.
10.1021/acs.jpcb.7b12259
- Ashbaugh, Henry. "Note: Second osmotic virial coefficients of short alkanes and their alcohol counterparts in water as a function
of temperature". The Journal of Chemical Physics (2018): http://dx.doi.org/10.1063/1.5008573.
10.1063/1.5008573
- Ashbaugh, Henry. "Alkane guest packing drives switching between multimeric deep-cavity cavitand assembly states". Chemical
Communications (2018): http://dx.doi.org/10.1039/c8cc00036k.
10.1039/c8cc00036k
- Ashbaugh, Henry. "Guest Controlled Nonmonotonic Deep Cavity Cavitand Assembly State Switching". The Journal of Physical
Chemistry B (2017): http://dx.doi.org/10.1021/acs.jpcb.7b09021.
10.1021/acs.jpcb.7b09021
- Ashbaugh, Henry. "Resolving solvophobic interactions inferred from experimental solvation free energies and evaluated from
molecular simulations". Chemical Physics Letters (2017): http://dx.doi.org/10.1016/j.cplett.2016.11.038.
10.1016/j.cplett.2016.11.038
- Ashbaugh, Henry. "Communication: Stiffening of dilute alcohol and alkane mixtures with water". The Journal of Chemical
Physics (2016): http://dx.doi.org/10.1063/1.4971205.
10.1063/1.4971205
- Ashbaugh, Henry. "Design of Amphiphilic Polymers via Molecular Dynamics Simulations". The Journal of Physical Chemistry
B (2016): http://dx.doi.org/10.1021/acs.jpcb.6b07791.
10.1021/acs.jpcb.6b07791
- Ashbaugh, Henry. "Succession of Alkane Conformational Motifs Bound within Hydrophobic Supramolecular Capsular Assemblies".
The Journal of Physical Chemistry B (2016): http://dx.doi.org/10.1021/acs.jpcb.6b06496.
10.1021/acs.jpcb.6b06496
- Ashbaugh, Henry. "Temperature and pressure dependence of the interfacial free energy against a hard surface in contact with
water and decane". The Journal of Chemical Physics (2016): http://dx.doi.org/10.1063/1.4963692.
10.1063/1.4963692
- Ashbaugh, Henry. "Hydrated nonpolar solute volumes: Interplay between size, Attractiveness, and molecular structure". Biophysical
Chemistry (2016): http://dx.doi.org/10.1016/j.bpc.2016.03.002.
10.1016/j.bpc.2016.03.002
- Ashbaugh, Henry. "Cooperative hydrophobe aggregation mediated by interfacially active alcohols". Fluid Phase Equilibria
(2016): http://dx.doi.org/10.1016/j.fluid.2015.05.049.
10.1016/j.fluid.2015.05.049
- Ashbaugh, Henry. "Temperature and Pressure Dependence of Methane Correlations and Osmotic Second Virial Coefficients in Water".
The Journal of Physical Chemistry B (2015): http://dx.doi.org/10.1021/acs.jpcb.5b02056.
10.1021/acs.jpcb.5b02056
- Ashbaugh, Henry. "Scaled-particle theory analysis of cylindrical cavities in solution". Physical Review E (2015): http://dx.doi.org/10.1103/physreve.91.042315.
10.1103/physreve.91.042315
- Ashbaugh, Henry. "Effect of Hydrostatic Pressure on Gas Solubilization in Micelles". Langmuir (2015): http://dx.doi.org/10.1021/la503646z.
10.1021/la503646z
- Ashbaugh, Henry. "Direct Evaluation of Polypeptide Partial Molar Volumes in Water Using Molecular Dynamics Simulations". Journal
of Chemical & Engineering Data (2014): http://dx.doi.org/10.1021/je5001999.
10.1021/je5001999
- Ashbaugh, Henry. "Molecular Dynamics Simulations of Linear and Cyclic Amphiphilic Polymers in Aqueous and Organic Environments".
The Journal of Physical Chemistry B (2014): http://dx.doi.org/10.1021/jp412184h.
10.1021/jp412184h
- Ashbaugh, Henry. "Note: Nonpolar solute partial molar volume response to attractive interactions with water". The Journal
of Chemical Physics (2014): http://dx.doi.org/10.1063/1.4861671.
10.1063/1.4861671
- Ashbaugh, Henry. "Simulation optimization of spherical non-polar guest recognition by deep-cavity cavitands". The Journal
of Chemical Physics (2013): http://dx.doi.org/10.1063/1.4844215.
10.1063/1.4844215
- Ashbaugh, Henry. "Molecular-scale hydrophobic interactions between hard-sphere reference solutes are attractive and endothermic".
Proceedings of the National Academy of Sciences (2013): http://dx.doi.org/10.1073/pnas.1312458110.
10.1073/pnas.1312458110
- Ashbaugh, Henry. "Pressure Reentrant Assembly: Direct Simulation of Volumes of Micellization". Langmuir (2013): http://dx.doi.org/10.1021/la402798f.
10.1021/la402798f
- Ashbaugh, Henry. "Solvent cavitation under solvophobic confinement". The Journal of Chemical Physics (2013): http://dx.doi.org/10.1063/1.4817661.
10.1063/1.4817661
- Ashbaugh, Henry. "Numerical Validation of IFT in the Analysis of Protein–Surfactant Complexes with SAXS and SANS". Langmuir
(2012): http://dx.doi.org/10.1021/la3028379.
10.1021/la3028379
- Ashbaugh, Henry. "Confinement induced conformational changes in n-alkanes sequestered within a narrow carbon nanotube". Physical
Chemistry Chemical Physics (2012): http://dx.doi.org/10.1039/c2cp22940d.
10.1039/c2cp22940d
- Ashbaugh, Henry. "Cosolvent Preferential Molecular Interactions in Aqueous Solutions". The Journal of Physical Chemistry
B (2011): http://dx.doi.org/10.1021/jp2083067.
10.1021/jp2083067
- Ashbaugh, Henry. "Optimization of linear and branched alkane interactions with water to simulate hydrophobic hydration". The
Journal of Chemical Physics (2011): http://dx.doi.org/10.1063/1.3623267.
10.1063/1.3623267
- Ashbaugh, Henry. "Helix Stabilization of Poly(ethylene glycol)–Peptide Conjugates". Biomacromolecules (2011): http://dx.doi.org/10.1021/bm2005017.
10.1021/bm2005017
- Ashbaugh, Henry. "Putting the squeeze on cavities in liquids: Quantifying pressure effects on solvation using simulations
and scaled-particle theory". The Journal of Chemical Physics (2011): http://dx.doi.org/10.1063/1.3510522.
10.1063/1.3510522
- Ashbaugh, Henry. "Carbon microspheres as network nodes in a novel biocompatible gel". Soft Matter (2011): http://dx.doi.org/10.1039/c0sm01430c.
10.1039/c0sm01430c
- Ashbaugh, Henry. "Assessing the thermodynamic signatures of hydrophobic hydration for several common water models". The
Journal of Chemical Physics (2010): http://dx.doi.org/10.1063/1.3366718.
10.1063/1.3366718
- Ashbaugh, Henry. "Tuning the Globular Assembly of Hydrophobic/Hydrophilic Heteropolymer Sequences". The Journal of Physical
Chemistry B (2009): http://dx.doi.org/10.1021/jp907398r.
10.1021/jp907398r
- Ashbaugh, Henry. "Entropy crossover from molecular to macroscopic cavity hydration". Chemical Physics Letters (2009):
http://dx.doi.org/10.1016/j.cplett.2009.06.081.
10.1016/j.cplett.2009.06.081
- Ashbaugh, Henry. "Blowing bubbles in Lennard-Jonesium along the saturation curve". The Journal of Chemical Physics
(2009): http://dx.doi.org/10.1063/1.3143716.
10.1063/1.3143716
- Ashbaugh, Henry. "Single ion hydration free energies: A consistent comparison between experiment and classical molecular simulation".
The Journal of Chemical Physics (2008): http://dx.doi.org/10.1063/1.3013865.
10.1063/1.3013865
- Ashbaugh, Henry. "Digging a hole: Scaled-particle theory and cavity solvation in organic solvents". The Journal of Chemical
Physics (2008): http://dx.doi.org/10.1063/1.3003577.
10.1063/1.3003577
- Ashbaugh, Henry. "Aqueous Partial Molar Volumes from Simulation and Individual Group Contributions". Industrial & Engineering
Chemistry Research (2008): http://dx.doi.org/10.1021/ie0714448.
10.1021/ie0714448
- Ashbaugh, Henry. "Natively Unfolded Protein Stability as a Coil-to-Globule Transition in Charge/Hydropathy Space". Journal
of the American Chemical Society (2008): http://dx.doi.org/10.1021/ja802124e.
10.1021/ja802124e
- Ashbaugh, Henry. "Non-van der Waals Treatment of the Hydrophobic Solubilities of CF4". Journal of the American Chemical
Society (2007): http://dx.doi.org/10.1021/ja071037n.
10.1021/ja071037n
- Ashbaugh, Henry. "Contrasting Nonaqueous against Aqueous Solvation on the Basis of Scaled-Particle Theory". The Journal
of Physical Chemistry B (2007): http://dx.doi.org/10.1021/jp071969d.
10.1021/jp071969d
- Ashbaugh, Henry. "Monomer Hydrophobicity as a Mechanism for the LCST Behavior of Poly(ethylene oxide) in Water". Industrial
& Engineering Chemistry Research (2006): http://dx.doi.org/10.1021/ie051131h.
10.1021/ie051131h
- Ashbaugh, Henry. "An analysis of molecular packing and chemical association in liquid water using quasichemical theory". The
Journal of Chemical Physics (2006): http://dx.doi.org/10.1063/1.2202350.
10.1063/1.2202350
- Ashbaugh, Henry. "Thermochromatism and Structural Evolution of Metastable Polydiacetylenic Crystals". The Journal of Physical
Chemistry B (2006): http://dx.doi.org/10.1021/jp060309q.
10.1021/jp060309q
- Ashbaugh, Henry. "Responsive Periodic Mesoporous Polydiacetylene/Silica Nanocomposites". Journal of the American Chemical
Society (2006): http://dx.doi.org/10.1021/ja0575732.
10.1021/ja0575732
- Ashbaugh, Henry. "Colloquium: Scaled particle theory and the length scales of hydrophobicity". Reviews of Modern Physics
(2006): http://dx.doi.org/10.1103/revmodphys.78.159.
10.1103/revmodphys.78.159
- Ashbaugh, Henry. "Mesoscopically ordered organosilica and carbon–silica hybrids with uniform morphology by surfactant-assisted
self-assembly of organo bis-silanetriols". Chemical Communications (2006): http://dx.doi.org/10.1039/b516985b.
10.1039/b516985b
- Ashbaugh, Henry. "Effects of nonpolar solutes on the thermodynamic response functions of aqueous mixtures". The Journal
of Chemical Physics (2005): http://dx.doi.org/10.1063/1.2075127.
10.1063/1.2075127
- Ashbaugh, Henry. "Polydiacetylene/Silica Nanocomposites with Tunable Mesostructure and Thermochromatism from Diacetylenic
Assembling Molecules". Journal of the American Chemical Society (2005): http://dx.doi.org/10.1021/ja053966p.
10.1021/ja053966p
- Ashbaugh, Henry. "Mesoscale model of polymer melt structure: Self-consistent mapping of molecular correlations to coarse-grained
potentials". The Journal of Chemical Physics (2005): http://dx.doi.org/10.1063/1.1861455.
10.1063/1.1861455
- Ashbaugh, Henry. "Deblurred Observation of the Molecular Structure of an Oil-Water Interface". Journal of the American
Chemical Society (2005): http://dx.doi.org/10.1021/ja042600u.
10.1021/ja042600u
- Ashbaugh, Henry. "Interaction of Paraffin Wax Gels with Ethylene/Vinyl Acetate Co-polymers". Energy & Fuels (2005):
http://dx.doi.org/10.1021/ef049910i.
10.1021/ef049910i
- Ashbaugh, Henry. "Response to “Comment on ‘A simple molecular thermodynamic theory of hydrophobic hydration’¿” [J. Chem. Phys.
119, 10448 (2003)]". The Journal of Chemical Physics (2003): http://dx.doi.org/10.1063/1.1619938.
10.1063/1.1619938
- Ashbaugh, Henry. "Hydration of krypton and consideration of clathrate models of hydrophobic effects from the perspective of
quasi-chemical theory". Biophysical Chemistry (2003): http://dx.doi.org/10.1016/s0301-4622(03)00084-x.
10.1016/s0301-4622(03)00084-x
- Ashbaugh, Henry. "Alkane Adsorption at the Water-Vapor Interface". Langmuir (2003): http://dx.doi.org/10.1021/la034559z.
10.1021/la034559z
- Ashbaugh, Henry. "Self-consistent molecular field theory for packing in classical liquids". Physical Review E (2003):
http://dx.doi.org/10.1103/physreve.68.021505.
10.1103/physreve.68.021505
- Ashbaugh, Henry. "Absolute hydration free energies of ions, ion–water clusters, and quasichemical theory". The Journal
of Chemical Physics (2003): http://dx.doi.org/10.1063/1.1587122.
10.1063/1.1587122
- Ashbaugh, Henry. "Gelation of "catanionic" vesicles by hydrophobically modified polyelectrolytes". Colloid & Polymer Science
(2002): http://dx.doi.org/10.1007/s00396-002-0702-3.
10.1007/s00396-002-0702-3
- Ashbaugh, Henry. "Interaction of Paraffin Wax Gels with Random Crystalline/Amorphous Hydrocarbon Copolymers". Macromolecules
(2002): http://dx.doi.org/10.1021/ma0204047.
10.1021/ma0204047
- Ashbaugh, Henry. "A simple molecular thermodynamic theory of hydrophobic hydration". The Journal of Chemical Physics
(2002): http://dx.doi.org/10.1063/1.1436479.
10.1063/1.1436479
- Ashbaugh, Henry. "Conformational equilibria of polar and charged flexible polymer chains in water". Polymer (2002):
http://dx.doi.org/10.1016/s1089-3156(01)00010-1.
10.1016/s1089-3156(01)00010-1
- Ashbaugh, Henry. "Flow improvement of waxy oils mediated by self-aggregating partially crystallizable diblock copolymers".
Journal of Rheology (2002): http://dx.doi.org/10.1122/1.1485280.
10.1122/1.1485280
- Ashbaugh, Henry. "Effect of Solute Size and Solute-Water Attractive Interactions on Hydration Water Structure around Hydrophobic
Solutes". Journal of the American Chemical Society (2001): http://dx.doi.org/10.1021/ja016324k.
10.1021/ja016324k
- Ashbaugh, Henry. "Temperature dependence of hydrophobic hydration and entropy convergence in an isotropic model of water".
The Journal of Chemical Physics (2001): http://dx.doi.org/10.1063/1.1379576.
10.1063/1.1379576
- Ashbaugh, Henry. "Swelling and Structural Changes of Oppositely Charged Polyelectrolyte Gel-Mixed Surfactant Complexes". Macromolecules
(2001): http://dx.doi.org/10.1021/ma001545g.
10.1021/ma001545g
- Ashbaugh, Henry. "Convergence of Molecular and Macroscopic Continuum Descriptions of Ion Hydration". The Journal of Physical
Chemistry B (2000): http://dx.doi.org/10.1021/jp0015067.
10.1021/jp0015067
- Ashbaugh, Henry. "Interactions of Cationic/Nonionic Surfactant Mixtures with an Anionic Hydrogel: Absorption Equilibrium
and Thermodynamic Modeling". Langmuir (2000): http://dx.doi.org/10.1021/la9910778.
10.1021/la9910778
- Ashbaugh, Henry. "A “Universal” Surface Area Correlation for Molecular Hydrophobic Phenomena". Journal of the American
Chemical Society (1999): http://dx.doi.org/10.1021/ja992119h.
10.1021/ja992119h
- Ashbaugh, Henry. "Influence of potential truncation on anisotropic systems". Molecular Physics (1999): http://dx.doi.org/10.1080/00268979909482843.
10.1080/00268979909482843
- Ashbaugh, Henry. "Conformational Equilibria of Alkanes in Aqueous Solution: Relationship to Water Structure Near Hydrophobic
Solutes". Biophysical Journal (1999): http://dx.doi.org/10.1016/s0006-3495(99)76920-1.
10.1016/s0006-3495(99)76920-1
- Ashbaugh, Henry. "Hydration and Conformational Equilibria of Simple Hydrophobic and Amphiphilic Solutes". Biophysical Journal
(1998): http://dx.doi.org/10.1016/s0006-3495(98)77565-4.
10.1016/s0006-3495(98)77565-4
- Ashbaugh, Henry. "Continuum Corrections to the Polarization and Thermodynamic Properties of Ewald Sum Simulations for Ions
and Ion Pairs at Infinite Dilution". The Journal of Physical Chemistry B (1998): http://dx.doi.org/10.1021/jp9808227.
10.1021/jp9808227
- Ashbaugh, Henry. "A Molecular/Continuum Thermodynamic Model of Hydration". The Journal of Physical Chemistry B (1998):
http://dx.doi.org/10.1021/jp9814505.
10.1021/jp9814505
- Ashbaugh, Henry. "Reply to Comment on “Electrostatic Potentials and Free Energies of Solvation of Polar and Charged Molecules”".
The Journal of Physical Chemistry B (1998): http://dx.doi.org/10.1021/jp9804852.
10.1021/jp9804852
- Ashbaugh, Henry. "Effects of long-range electrostatic potential truncation on the free energy of ionic hydration". The
Journal of Chemical Physics (1997): http://dx.doi.org/10.1063/1.473800.
10.1063/1.473800
- Ashbaugh, Henry. "The hydrophobic effect". Current Opinion in Colloid & Interface Science (1996): http://dx.doi.org/10.1016/s1359-0294(96)80137-3.
10.1016/s1359-0294(96)80137-3
- Ashbaugh, Henry. "Entropy of Hydrophobic Hydration: Extension to Hydrophobic Chains". The Journal of Physical Chemistry
(1996): http://dx.doi.org/10.1021/jp952387b.
10.1021/jp952387b
- Ashbaugh, Henry. "The entropy of hydration of simple hydrophobic solutes". Biophysical Chemistry (1994): http://dx.doi.org/10.1016/0301-4622(94)00055-7.
10.1016/0301-4622(94)00055-7
|
