Extended molecular Ornstein-Zernike integral equation for fully anisotropic solute molecules: formulation in a rectangular coordinate system.
about
A highly efficient hybrid method for calculating the hydration free energy of a protein.Small molecule hydration energy and entropy from 3D-RISM.Efficient molecular density functional theory using generalized spherical harmonics expansions.A hybrid framework of first principles molecular orbital calculations and a three-dimensional integral equation theory for molecular liquids: multi-center molecular Ornstein-Zernike self-consistent field approach.3DRISM-HI-D2MSA: an improved analytic theory to compute solvent structure around hydrophobic solutes with proper treatment of solute–solvent electrostatic interactions
P2860
Extended molecular Ornstein-Zernike integral equation for fully anisotropic solute molecules: formulation in a rectangular coordinate system.
description
2013 nî lūn-bûn
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name
Extended molecular Ornstein-Ze ...... rectangular coordinate system.
@en
Extended molecular Ornstein-Ze ...... rectangular coordinate system.
@nl
type
label
Extended molecular Ornstein-Ze ...... rectangular coordinate system.
@en
Extended molecular Ornstein-Ze ...... rectangular coordinate system.
@nl
prefLabel
Extended molecular Ornstein-Ze ...... rectangular coordinate system.
@en
Extended molecular Ornstein-Ze ...... rectangular coordinate system.
@nl
P2860
P356
P1476
Extended molecular Ornstein-Ze ...... rectangular coordinate system.
@en
P2093
Ryosuke Ishizuka
P2860
P304
P356
10.1063/1.4819211
P407
P577
2013-08-01T00:00:00Z