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The systems were solvated using the SPC water model.
Despite resistance from the business community, experts warn that Chile's neoliberal water model cannot be sustained.
We used the recently developed parmBSC1 force field41, and TIP3P for the water model.
82 rural districts where the state government wants to copy the PepsiCo Foundation-funded drinking water model.
A correct water model has to be tetrahedral and flexible.
Numerical simulations for the water model were performed.
Horn, H. W. et al. Development of an improved four-site water model for biomolecular simulations: TIP4P-Ew.
Fraccarollo, L. & Toro, E. F. Experimental and numerical assessment of the shallow water model for two-dimensional dam-break type problems.
All generated structural models were placed in a cubic box with dimensions of 74 × 74 × 74 Å and were subsequently solvated using the TIP3P water model.
The whole structure has been tested successfully by means of water model experiments.
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The dual-water model.
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