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 | 80 | 2010 |
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 | 65 | 2012 |
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 | 31 | 2012 |
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 | 29 | 2010 |
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 | 26 | 2012 |
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 | 14 | 2015 |
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 | 10 | 2005 |
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 | 8 | 2012 |
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 | 7 | 2005 |
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 | 2 | 2009 |
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 |