@@ -48,6 +48,7 @@ def _group_parameter(group_name):
4848 REPLACE_TRUE_PARAMETER
4949 ],
5050 name = 'one-way-shooting' ,
51+ description = "Use one-way-shooting moves in this move scheme." ,
5152)
5253build_one_way_shooting_strategy = ONE_WAY_SHOOTING_STRATEGY_PLUGIN
5354
@@ -70,6 +71,8 @@ def _group_parameter(group_name):
7071 REPLACE_TRUE_PARAMETER
7172 ],
7273 name = 'nearest-neighbor-repex' ,
74+ description = ("Use replica exchange only between neearest-neighbor "
75+ "interfaces in this move scheme" ),
7376)
7477
7578build_all_set_repex_strategy = StrategyCompilerPlugin (
@@ -79,6 +82,8 @@ def _group_parameter(group_name):
7982 REPLACE_TRUE_PARAMETER
8083 ],
8184 name = 'all-set-repex' ,
85+ description = ("Use replica exchange allowing swap attempts between any "
86+ "pair of ensembles within the same interface set." ),
8287)
8388
8489build_path_reversal_strategy = StrategyCompilerPlugin (
@@ -88,6 +93,7 @@ def _group_parameter(group_name):
8893 REPLACE_TRUE_PARAMETER ,
8994 ],
9095 name = 'path-reversal' ,
96+ description = "Use path reversal moves in this move scheme." ,
9197)
9298
9399build_minus_move_strategy = StrategyCompilerPlugin (
@@ -98,6 +104,9 @@ def _group_parameter(group_name):
98104 REPLACE_TRUE_PARAMETER ,
99105 ],
100106 name = 'minus' ,
107+ description = ("Use the minus move in this move scheme. This strategy "
108+ "uses the M-shaped, or multiple interface set minus "
109+ "move, and always keeps a sample in the minus interface." ),
101110)
102111
103112build_single_replica_minus_move_strategy = StrategyCompilerPlugin (
@@ -108,6 +117,12 @@ def _group_parameter(group_name):
108117 REPLACE_TRUE_PARAMETER ,
109118 ],
110119 name = 'single-replica-minus' ,
120+ description = ("Use the single-replica minus move in this move scheme. "
121+ "This strategy does not keep a replica in the minus "
122+ "ensemble; instead, that trajectory is only temporarily "
123+ "created during this move. This should not be used if "
124+ "there are multiple interface sets with the same initial "
125+ "state." ),
111126)
112127
113128STRATEGY_COMPILER = CategoryPlugin (StrategyCompilerPlugin ,
0 commit comments