Skip to content
Snippets Groups Projects
Commit 23aadc7d authored by Gerardo Tauriello's avatar Gerardo Tauriello
Browse files

Make optimize_subrotamers handling default.

parent 81f4c420
Branches
Tags
No related merge requests found
......@@ -354,7 +354,7 @@ def _GetDisulfidBridges(frame_residues, cystein_indices, res_list, rotamer_libra
def Reconstruct(ent, keep_sidechains=False, build_disulfids=True,
rotamer_model="frm", consider_ligands=True,
rotamer_library=None, optimize_subrotamers = False,
rotamer_library=None, optimize_subrotamers=True,
graph_max_complexity=100000000, graph_initial_epsilon=0.02):
'''Reconstruct sidechains for the given structure.
......@@ -385,7 +385,7 @@ def Reconstruct(ent, keep_sidechains=False, build_disulfids=True,
library.
:type rotamer_library: :class:`BBDepRotamerLib` / :class:`RotamerLib`
:param optimize_subrotamers: Only considered when **rotamer_model**
:param optimize_subrotamers: Only considered when *rotamer_model*
is "frm".
If set to True, the FRM solution undergoes
some postprocessing by calling
......
0% Loading or .
You are about to add 0 people to the discussion. Proceed with caution.
Please register or to comment