109 citations · 268 across the 6 of their papers we have counts for
6 papers
Local Volume Concentration, Packing Domains and Scaling Properties of Chromatin
Marcelo Carignano, Martin Kröger, Luay Almassalha +6
We propose the Self Returning Excluded Volume (SR-EV) model for the structure of chromatin based on stochastic rules and physical interactions. The SR-EV rules of return generate c…
Association Free Energies of Metal Cations with Mesylate and Acetate in Brine Calculated via Molecular Dynamics Simulation
Sung Hyun Park, Rikkert J. Nap, Igal Szleifer
Here we report results from fully-atomistic molecular dynamics simulations and present the calculated binding free energies of the associations between metal cations and anionic fu…
The water supercooled regime as described by four common water models
David C. Malaspina, Aleida J. Bermudez di Lorenzo, Rodolfo G. Pereyra +2
The temperature scale of simple water models in general does not coincide with the natural one. Therefore, in order to make a meaningful evaluation of different water models a temp…
Phase diagram of a ternary mixture of cholesterol and saturated and unsaturated lipids calculated from a microscopic model
R. Elliott, I. Szleifer, M. Schick
We employ a molecular model to study a ternary mixture of saturated lipid, with tails of sixteen carbons, a mono unsaturated lipid with tails of eighteen carbons, and cholesterol.…
Phase Separation of Saturated and Mono-unsaturated Lipids as determined from a Microscopic Model
R. Elliott, K. Katsov, M. Schick +1
A molecular model is proposed of a bilayer consisting of fully saturated DPPC and mono unsaturated DOPC. The model not only encompasses the constant density within the hydrophobic…
Monolayers of Diblock Copolymer at the Air-Water Interface: The Attractive Monomer-Surface Case
M. C. Fauré, P. Bassereau, M. A. Carignano +3
We have studied both experimentally and theoretically the surface pressure isotherms of copolymers of polystyrene-polyethyleneoxide (PS-PEO) at the air-water interface. The SCMF (s…