Cell Lists

Cell lists (also sometimes referred to as Cell linked-lists) are a tool for finding all atom pairs within a given cut-off distance of each other in Molecular dynamics simulations. These pairs are needed to compute the short-range non-bonded interactions in a system, such as Van der Waals forces or the short-range part of the electrostatic interaction when using Ewald summation.

Read more about Cell Lists:  Algorithm, Periodic Boundary Conditions, Improvements

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