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one authoredAvoid forcing Coulomb PME to re-sort whenever LJ-PME is enabled, and give dispersion PME its own atom-grid index and sort state so the performance impact can be measured independently.
c1d643e2
Avoid forcing Coulomb PME to re-sort whenever LJ-PME is enabled, and give dispersion PME its own atom-grid index and sort state so the performance impact can be measured independently.