I have been meaning to speed up some of the non-bonded force calculation in Molly.jl and I had a play with it today, but found I hit a ceiling. I have extracted a simplistic molecular dynamics simulation of a Lennard Jones fluid as a MWE and would appreciate any tips on how to make it faster. The c…

Help make my ideal gas simulation ideally fast

LaurentPlagne May 8, 2020, 9:56pm 2

You could store 1/r2.
Maybe use gflop.jl to see how fast you already are

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