受强制性开放获取政策约束的文章 - Christopher R. Iacovella了解详情
无法在其他位置公开访问的文章：1 篇
Influence of surface morphology on the shear-induced wear of alkylsilane monolayers: Molecular dynamics study
AZ Summers, CR Iacovella, MR Billingsley, ST Arnold, PT Cummings, ...
Langmuir 32 (10), 2348-2359, 2016
强制性开放获取政策： US National Science Foundation, US Department of Energy
可在其他位置公开访问的文章：29 篇
Derivation of coarse-grained potentials via multistate iterative Boltzmann inversion
TC Moore, CR Iacovella, C McCabe
The Journal of chemical physics 140 (22), 2014
强制性开放获取政策： US National Institutes of Health
Simulation study of the structure and phase behavior of ceramide bilayers and the role of lipid headgroup chemistry
S Guo, TC Moore, CR Iacovella, LA Strickland, C McCabe
Journal of chemical theory and computation 9 (11), 5116-5126, 2013
强制性开放获取政策： US National Institutes of Health
A hierarchical, component based approach to screening properties of soft matter
C Klein, J Sallai, TJ Jones, CR Iacovella, C McCabe, PT Cummings
Foundations of molecular modeling and simulation: Select papers from FOMMS …, 2016
强制性开放获取政策： US National Science Foundation
Formalizing atom-typing and the dissemination of force fields with foyer
C Klein, AZ Summers, MW Thompson, JB Gilmer, C McCabe, ...
Computational Materials Science 167, 215-227, 2019
强制性开放获取政策： US National Science Foundation, US Department of Energy
Effect of ceramide tail length on the structure of model stratum corneum lipid bilayers
TC Moore, R Hartkamp, CR Iacovella, AL Bunge, C McCabe
Biophysical Journal 114 (1), 113-125, 2018
强制性开放获取政策： US National Science Foundation, US Department of Energy, US National …
Molecular dynamics study of alkylsilane monolayers on realistic amorphous silica surfaces
JE Black, CR Iacovella, PT Cummings, C McCabe
Langmuir 31 (10), 3086-3093, 2015
强制性开放获取政策： US Department of Energy
An atomistic carbide-derived carbon model generated using reaxff-based quenched molecular dynamics
MW Thompson, B Dyatkin, HW Wang, CH Turner, X Sang, RR Unocic, ...
C 3 (4), 32, 2017
强制性开放获取政策： US Department of Energy
MoSDeF, a python framework enabling large-scale computational screening of soft matter: Application to chemistry-property relationships in lubricating monolayer films
AZ Summers, JB Gilmer, CR Iacovella, PT Cummings, C McCabe
Journal of Chemical Theory and Computation 16 (3), 1779-1793, 2020
强制性开放获取政策： US National Science Foundation, US Department of Energy, US National …
Open‐source molecular modeling software in chemical engineering focusing on the Molecular Simulation Design Framework
PT Cummings, CR Iacovella, A Ledeczi, E Jankowski, A Jayaraman, ...
John Wiley & Sons, Inc., 2021
强制性开放获取政策： US National Science Foundation
Towards molecular simulations that are transparent, reproducible, usable by others, and extensible (TRUE)
MW Thompson, JB Gilmer, RA Matsumoto, CD Quach, P Shamaprasad, ...
Molecular physics 118 (9-10), e1742938, 2020
强制性开放获取政策： US National Science Foundation, US Department of Energy, US National …
A coarse-grained model of stratum corneum lipids: free fatty acids and ceramide NS
TC Moore, CR Iacovella, R Hartkamp, AL Bunge, C McCabe
The Journal of Physical Chemistry B 120 (37), 9944-9958, 2016
强制性开放获取政策： US National Science Foundation, US Department of Energy, US National …
Molecular dynamics simulations of stratum corneum lipid mixtures: A multiscale perspective
TC Moore, CR Iacovella, AC Leonhard, AL Bunge, C McCabe
Biochemical and biophysical research communications 498 (2), 313-318, 2018
强制性开放获取政策： US National Science Foundation, US Department of Energy, US National …
Using molecular simulation to understand the skin barrier
P Shamaprasad, CO Frame, TC Moore, A Yang, CR Iacovella, ...
Progress in lipid research 88, 101184, 2022
强制性开放获取政策： US Department of Energy, US National Institutes of Health
Investigating the structure of multicomponent gel-phase lipid bilayers
R Hartkamp, TC Moore, CR Iacovella, MA Thompson, PA Bulsara, ...
Biophysical Journal 111 (4), 813-823, 2016
强制性开放获取政策： US Department of Energy
Investigating alkylsilane monolayer tribology at a single-asperity contact with molecular dynamics simulation
AZ Summers, CR Iacovella, PT Cummings, C McCabe
Langmuir 33 (42), 11270-11280, 2017
强制性开放获取政策： US National Science Foundation, US Department of Energy
Tunable transition from hydration to monomer-supported lubrication in zwitterionic monolayers revealed by molecular dynamics simulation
C Klein, CR Iacovella, C McCabe, PT Cummings
Soft Matter 11 (17), 3340-3346, 2015
强制性开放获取政策： US Department of Energy
Examining the phase transition behavior of amphiphilic lipids in solution using statistical temperature molecular dynamics and replica-exchange Wang-Landau methods
L Gai, T Vogel, KA Maerzke, CR Iacovella, DP Landau, PT Cummings, ...
The Journal of Chemical Physics 139 (5), 2013
强制性开放获取政策： US National Institutes of Health
Composition dependence of water permeation across multicomponent gel-phase bilayers
R Hartkamp, TC Moore, CR Iacovella, MA Thompson, PA Bulsara, ...
The Journal of Physical Chemistry B 122 (12), 3113-3123, 2018
强制性开放获取政策： US Department of Energy
Perfluoropolyethers: development of an all-atom force field for molecular simulations and validation with new experimental vapor pressures and liquid densities
JE Black, GMC Silva, C Klein, CR Iacovella, P Morgado, LFG Martins, ...
The Journal of Physical Chemistry B 121 (27), 6588-6600, 2017
强制性开放获取政策： US National Science Foundation, US Department of Energy, US Department of …
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