Dominant solvation effects from the primary shell of hydration: Approximation for molecular dynamics simulations
D Beglov, B Roux - Biopolymers: Original Research on …, 1995 - Wiley Online Library
A simple approximation is developed to account for the dominant effects of solvation in
molecular dynamics simulations of biopolymers. A small number of water molecules are …
molecular dynamics simulations of biopolymers. A small number of water molecules are …
[PDF][PDF] Dominant Solvation Effects from the Primary Shell of
D Beglov, B Roux - Biopolymers, 1995 - academia.edu
A simple approximation is developed to account for the dominant efects of solvation in
molecular dynamics simulations of biopolymers. A small number of water molecules are …
molecular dynamics simulations of biopolymers. A small number of water molecules are …