Development of a coarse-grained model for simulations of tridecanoin liquid–solid phase transitions

A transferable coarse-grained potential to study the structure of confined, supercritical Lennard-Jones fluids

(2010) T. Sanghi et al.   JOURNAL OF CHEMICAL PHYSICS

A coarse-grained model for amorphous and crystalline fatty acids

(2010) K. R. Hadley et al.   JOURNAL OF CHEMICAL PHYSICS

Zwitterionic Lipid Assemblies: Molecular Dynamics Studies of Monolayers, Bilayers, and Vesicles Using a New Coarse Grain Force Field

(2010) Wataru Shinoda et al.   JOURNAL OF PHYSICAL CHEMISTRY B

A Systematically Coarse-Grained Solvent-Free Model for Quantitative Phospholipid Bilayer Simulations

(2010) Zun-Jing Wang et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Reactive Molecular Dynamics with Material-Specific Coarse-Grained Potentials: Growth of Polystyrene Chains from Styrene Monomers

(2010) Karim Farah et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Molecular Simulation Study of the Structure of High Density Polymer Brushes in Good Solvent

(2010) Ian G. Elliott et al.   MACROMOLECULES

Systematic implicit solvent coarse-graining of bilayer membranes: lipid and phase transferability of the force field

(2010) Zun-Jing Wang et al.   NEW JOURNAL OF PHYSICS

Comment on “On using a too large integration time step in molecular dynamics simulations of coarse-grained molecular models” by M. Winger, D. Trzesniak, R. Baron and W. F. van Gunsteren, Phys. Chem. Chem. Phys., 2009, 11, 1934

(2010) Siewert J. Marrink et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Coarse grain modeling of polyimide copolymers

(2010) Arnab Chakrabarty et al.   POLYMER

Order−Disorder Phase Transformation of Triacylglycerols: Effect of the Structure of the Aliphatic Chains

(2009) Wen-Dung Hsu et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Coarse-Grained Polymer Melts Based on Isolated Atomistic Chains: Simulation of Polystyrene of Different Tacticities

(2009) Dominik Fritz et al.   MACROMOLECULES

Multiscale simulation of soft matter systems – from the atomistic to the coarse-grained level and back

(2009) Christine Peter et al.   Soft Matter

Fast dynamics in coarse-grained polymer models: The effect of the hydrogen bonds

(2008) Hossein Ali Karimi-Varzaneh et al.   JOURNAL OF CHEMICAL PHYSICS

Transferability of coarse-grained force fields: The polymer case

(2008) Paola Carbone et al.   JOURNAL OF CHEMICAL PHYSICS

Modeling of the Triglyceride-Rich Core in Lipoprotein Particles

(2008) Anette Hall et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Temperature-Transferable Coarse-Grained Potentials for Ethylbenzene, Polystyrene, and Their Mixtures

(2008) Hu-Jun Qian et al.   MACROMOLECULES

Molecular Dynamics Simulations of Functional Group Effects on Solvation Thermodynamics of Model Solutes in Decane and Tricaprylin

(2008) Sagar S. Rane et al.   MOLECULAR PHARMACEUTICS

Classical simulations from the atomistic to the mesoscale and back: coarse graining an azobenzene liquid crystal

(2008) Christine Peter et al.   Soft Matter

What determines drug solubility in lipid vehicles: Is it predictable?

(2007) Sagar S. Rane et al.   ADVANCED DRUG DELIVERY REVIEWS