deepfold.relax.utils

Utils for minimization.

Functions

assert_equal_nonterminal_atom_types(...)	Checks that pre- and post-minimized proteins have same atom set.
overwrite_b_factors(pdb_str, bfactors)	Overwrites the B-factors in pdb_str with contents of bfactors array.
overwrite_pdb_coordinates(pdb_str, pos)