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Jeremy A. Yancey
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Assessment of the transferability of a protein force field for the simulation of peptide-surface interactions
NA Vellore, JA Yancey, G Collier, RA Latour, SJ Stuart
Langmuir 26 (10), 7396-7404, 2010
802010
Comparison between empirical protein force fields for the simulation of the adsorption behavior of structured LK peptides on functionalized surfaces
G Collier, NA Vellore, JA Yancey, SJ Stuart, RA Latour
Biointerphases 7 (1), 2012
652012
Simulation of multiphase systems utilizing independent force fields to control intraphase and interphase behavior
PK Biswas, NA Vellore, JA Yancey, TG Kucukkal, G Collier, BR Brooks, ...
Journal of computational chemistry 33 (16), 1458-1466, 2012
312012
Development of molecular simulation methods to accurately represent protein-surface interactions: The effect of pressure and its determination for a system with constrained atoms
JA Yancey, NA Vellore, G Collier, SJ Stuart, RA Latour
Biointerphases 5 (3), 85-95, 2010
292010
Development of a tuned interfacial force field parameter set for the simulation of protein adsorption to silica glass
JA Snyder, T Abramyan, JA Yancey, AA Thyparambil, Y Wei, SJ Stuart, ...
Biointerphases 7 (1), 2012
262012
Parameterization of an interfacial force field for accurate representation of peptide adsorption free energy on high-density polyethylene
TM Abramyan, JA Snyder, JA Yancey, AA Thyparambil, Y Wei, SJ Stuart, ...
Biointerphases 10 (2), 2015
142015
Terrace width distributions for vicinal surfaces with steps of alternating stiffness
JA Yancey, HL Richards, TL Einstein
Surface science 598 (1-3), 78-87, 2005
92005
Understanding Protein-Surface Interactions at the Atomistic Level through the Synergistic Development of Experimental and Molecular Simulation Methods
T Abramyan, G Collier, TG Kucukkal, X Li, JA Snyder, AA Thyparambil, ...
Proteins at Interfaces III State of the Art, 197–228, 2012
82012
Magnetic small world nanomaterials: Physical small-world networks
MA Novotny, X Zhang, J Yancey, T Dubreus, ML Cook, SG Gill, ...
Journal of applied physics 97 (10), 2005
72005
Small Pure Carbon Molecules with Small-World Networks Using Density Functional Theory Simulations
JA Yancey, MA Novotny, SR Gwaltney
International Journal of Modern Physics C 20 (09), 1345-1356, 2009
22009
Interfacial force field parameterization in CHARMM for the accurate representation of peptide adsorption free energy on high-density polyethylene
T Abramyan, J Snyder, J Yancey, S Stuart, R Latour
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 249, 2015
2015
Development of a tuned interfacial force field for the simulation of protein adsorption to poly (methyl methacrylate)
J Yancey, T Abramyan, J Snyder, S Stuart, R Latour
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 249, 2015
2015
Development of interfacial force field capabilities in LAMMPS to facilitate the accurate simulation of interfacial behavior
RA Latour, JA Yancey, CD Lorenz
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 247, 2014
2014
Validation of a tuned interfacial parameter set using dual-force-field CHARMM for the accurate simulation of protein adsorption on a silica glass surface
J Snyder, T Abramyan, JA Yancey, SJ Stuart, RA Latour
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 245, 2013
2013
Accurate modeling of peptide-surface interactions: Interfacial force field parameterization for organic functional groups
NA Vellore, JA Yancey, SJ Stuart, RA Latour
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 244, 2012
2012
Accurate molecular dynamics simulation of peptide adsorption to polyethylene, poly (methyl-methacrylate), and silica surfaces using dual-force-field in CHARMM
T Abramyan, J Snyder, J Yancey, SJ Stuart, RA Latour
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 244, 2012
2012
Modeling multiphase systems with independent force fields controlling intra-and inter-phase interactions
JA Yancey, P Biswas, NA Vellore, TG Kucukkal, G Collier, BR Brooks, ...
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 243, 2012
2012
Building Physical Carbon Nanoparticles from Small-World Networks: Density Functional Theory Calculations
JA Yancey, MA Novotny, SR Gwaltney
APS March Meeting Abstracts, B30. 012, 2008
2008
Small World Carbon Nanomaterials: Density Functional Theory Simulations
J Yancey, M Novotny, S Gwaltney
APS March Meeting Abstracts, W27. 006, 2007
2007
Quasi Small-World Nanomaterials: Quantum Studies
MA Novotny, J Yancey, S Gwaltney, S Caliskan
APS March Meeting Abstracts, A32. 012, 2006
2006
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