Affine coordinate transformation
Introduce a class that performs affine coordinate transformations of the form A*x+t
with an input matrix A
and a shift vector t
.
This greatly facilitates implementation of affine coordinate transformations in density-guided simulations which are needed, e.g., for density-fitting of membrane systems.
See also the planned release notes
- Density guided simulations can be run against user-translated and transformed input densities
- Affine transformation of trajectory tool
- Rigid-body fitting to density tool
Part of #3581