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Gromacs
2026.0-dev-20251109-f20ba35
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#include <gromacs/ewald/pme_internal.h>
Coefficients for theta or dtheta.
Public Member Functions | |
| void | realloc (int nalloc) |
| Reallocate for use with up to nalloc coefficients. | |
Public Attributes | |
| std::array< real *, DIM > | coefficients = { { nullptr } } |
| Pointers to the coefficient buffer for x, y, z. | |
1.8.5