Inter-DNA Electrostatics from Explicit Solvent Molecular Dynamics Simulations
Inter-DNA Electrostatics from Explicit Solvent Molecular Dynamics Simulations is a scholarly work by Garegin A Papoian, published in 2007 in ''Journal of the American Chemical Society''. The main subjects of the publication include ion, chemistry, molecule, computational chemistry, base, chemical physics, counterion, G-quadruplex, molecular dynamics simulation, nanofluidics, water model, Solvent models, energy, dynamics, static electricity, polyelectrolytes, solvent, electrostatics, statistical physics, and deoxyribonucleic acid. Electrostatic repulsion between two DNA molecules, computed from explicit water-free energy simulations, is screened stronger by Na+ counterions than K+ counterions.