# An Analytical Coarse-Grained Potential from Integral Equation Theory

J. A. Clark, J. McCarty, M. G. Guenza *“Effective Potentials for Representing Polymers in Melts as Chains of Interacting Soft Particles”* J. Chem. Phys. 139, 124906 (2013).

A. Clark, J. McCarty, I. Y. Lyubimov, M. G. Guenza *“Thermodynamic consistency in variable-level coarse-graining of polymeric liquids**”* Physical Review Letters 109, 168301-5 (2012).

A. J. Clark, and M. G. Guenza *“Mapping of Polymer Melts onto Soft-Colloidal Chains* Journal of Chemical Physics 132, 044902-12 (2010).

# Thermodynamic Consistency of the Integral Equation Coarse Grained Model

J. McCarty, A. Clark, J. Copperman, and M. G. Guenza *“Accurate Determination of the Thermodynamic Properties of Polymer Melts from Highly Coarse-Grained Simulation and Theory**” *J. Chem. Phys. 140, 204913 (2014).

J. McCarty, A. Clark, I. Y. Lyubimov, M. G. Guenza *“Thermodynamic Consistency between Analytical Integral Equation Theory and Coarse-Grained Molecular Dynamics Simulations of Homopolymer Melts”* Macromolecules 45, 8482-8493 (2012).

A. Clark, J. McCarty, I. Y. Lyubimov, M. G. Guenza *“Thermodynamic consistency in variable-level coarse-graining of polymeric liquids**”* Physical Review Letters 109, 168301-5 (2012).

# Dynamical Reconstruction of Coarse-Grained Dynamics

I. Y. Lyubimov, M.G. Guenza *“**Theoretical Reconstruction of Realistic Dynamics of Highly Coarse-Grained cis-1,4-Polybutadiene Melts” *J. Chem. Phys.* *138, 12A546 (2013).

I. Y. Lyubimov, and M. G. Guenza *“A First Principle Approach to Rescale the Dynamics of Simulated Coarse-Grained Macromolecular Liquids”*, Physical Review E 84, 031801-19 (2011).

I. Y. Lyubimov, J. McCarty, A. Clark, and M. G. Guenza *“Analytical Rescaling of Polymer Dynamics from Mesoscale Simulations”* Journal of Chemical Physics 132, 2249031-5 (2010).

# Coarse-Grained Polymer Mixtures

J. McCarty, and M. G. Guenza “*Multiscale Modeling of Polymer Mixtures: Scale Bridging in the Athermal and Thermal Regime”* Journal of Chemical Physics 133, 094904-15 (2010).

J. McCarty, I. Y. Lyubimov, and M. G. Guenza *“Effective Soft-Core Potentials and Mesoscopic Simulations of Binary Polymer Mixtures”* Macromolecules 43, 3964-3979 (2010).

G. Yatsenko, E. J. Sambriski, and M. G. Guenza “Coarse-Grained Description of Polymer Blends as Interacting Soft-Colloidal Particles” Journal of Chemical Physics 122, 054907 (2005).

G. Yatsenko, E. J. Sambriski, M. A. Nemirovskaya, and M. Guenza “Analytical Soft-Core Potentials for Macromolecular Fluids and Mixtures” Physical Review Letters 93, 2578031 (2004).

# Integral Equation Coarse-Graining of Block Copolymers

E. J. Sambriski, and M. G. Guenza “Theoretical Coarse-Graining Approach to Bridge Length Scales in Diblock Copolymer Liquids” Physical Review E 76, 051801-13 (2007).