Direct Derivation of Free Energies of Membrane Deformation and Other Solvent Density Variations From Enhanced Sampling Molecular Dynamics

von Fiorin, Giacomo
Veröffentlicht in: Journal of computational chemistry (2020)

Structure of water at charged interfaces a molecular dynamics study

von Dewan, Shalaka
Veröffentlicht in: Langmuir : the ACS journal of surfaces and colloids (2014)