Gromacs
2025-dev-20240906-b7d3419
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Helper structure for sorting positions along rotation vector.
Public Attributes | |
real | xcproj |
Projection of xc on the rotation vector. | |
int | ind |
Index of xc. | |
real | m |
Mass. | |
rvec | x |
Position. | |
rvec | x_ref |
Reference position. | |