Simple electrolyte solutions: comparison of DRISM and molecular dynamics results for alkali halide solutions.
about
Accurate small and wide angle x-ray scattering profiles from atomic models of proteins and nucleic acids.Communication: Accurate hydration free energies at a wide range of temperatures from 3D-RISM.Assessment of metal-assisted nucleophile activation in the hepatitis delta virus ribozyme from molecular simulation and 3D-RISM.Competitive interaction of monovalent cations with DNA from 3D-RISM.Ion counting from explicit-solvent simulations and 3D-RISM.Small molecule hydration energy and entropy from 3D-RISM.Extracting water and ion distributions from solution x-ray scattering experiments.How Water's Properties Are Encoded in Its Molecular Structure and Energies.SAMPL5: 3D-RISM partition coefficient calculations with partial molar volume corrections and solute conformational sampling.3D RISM theory with fast reciprocal-space electrostatics.Acidity in DMSO from the embedded cluster integral equation quantum solvation model.Multiple time step molecular dynamics in the optimized isokinetic ensemble steered with the molecular theory of solvation: accelerating with advanced extrapolation of effective solvation forces.Molecular simulation of aqueous electrolytes: water chemical potential results and Gibbs-Duhem equation consistency tests.
P2860
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P2860
Simple electrolyte solutions: comparison of DRISM and molecular dynamics results for alkali halide solutions.
description
2013 nî lūn-bûn
@nan
2013年の論文
@ja
2013年論文
@yue
2013年論文
@zh-hant
2013年論文
@zh-hk
2013年論文
@zh-mo
2013年論文
@zh-tw
2013年论文
@wuu
2013年论文
@zh
2013年论文
@zh-cn
name
Simple electrolyte solutions: ...... s for alkali halide solutions.
@en
Simple electrolyte solutions: ...... s for alkali halide solutions.
@nl
type
label
Simple electrolyte solutions: ...... s for alkali halide solutions.
@en
Simple electrolyte solutions: ...... s for alkali halide solutions.
@nl
prefLabel
Simple electrolyte solutions: ...... s for alkali halide solutions.
@en
Simple electrolyte solutions: ...... s for alkali halide solutions.
@nl
P2093
P2860
P356
P1476
Simple electrolyte solutions: ...... s for alkali halide solutions.
@en
P2093
David A Case
In Suk Joung
Tyler Luchko
P2860
P304
P356
10.1063/1.4775743
P407
P577
2013-01-01T00:00:00Z