Changeset d91a8f for src/Actions/GlobalListOfActions.hpp

Timestamp:

Dec 27, 2022, 11:36:18 PM (3 years ago)

Author:

Frederik Heber <frederik.heber@…>

Branches:

Candidate_v1.7.0, stable

Children:

c53ae2

Parents:

fb08cc

git-author:

Frederik Heber <frederik.heber@…> (12/27/22 23:28:57)

git-committer:

Frederik Heber <frederik.heber@…> (12/27/22 23:36:18)

Message:

Added ClearHomologiesAction.

• this is necessary during sampling where we accumulate a lot of homologies for the very same fragment.
• DOC: Added doc string.

File:

• src/Actions/GlobalListOfActions.hpp (modified) (1 diff)

src/Actions/GlobalListOfActions.hpp

@@ -105 +105 @@
   (MoleculeTranslate) \
   (MoleculeVerletIntegration) \
+  (PotentialClearHomologies) \
   (PotentialFitPartialCharges) \
   (PotentialGeneratePotentials) \