Source code for dials.util.ioutil
[docs]def get_inverse_ub_matrix_from_xparm(handle):
"""Get the inverse_ub_matrix from an xparm file handle
Params:
handle The file handle
Returns:
The inverse_ub_matrix
"""
from scitbx import matrix
return matrix.sqr(
handle.unit_cell_a_axis + handle.unit_cell_b_axis + handle.unit_cell_c_axis
)
[docs]def get_space_group_type_from_xparm(handle):
"""Get the space group tyoe object from an xparm file handle
Params:
handle The file handle
Returns:
The space group type object
"""
from cctbx import sgtbx
return sgtbx.space_group_type(
sgtbx.space_group(sgtbx.space_group_symbols(handle.space_group).hall())
)