Changeset b794f5 for src/Potentials/EmpiricalPotential.hpp

Timestamp:

Oct 3, 2016, 5:26:53 PM (9 years ago)

Author:

Frederik Heber <heber@…>

Branches:

Fix_FitPotential_needs_atomicnumbers

Children:

ce0b0c

Parents:

7ec605

Message:

tempcommit: Add ..Potentials need to supply PotentialSubgraph instead of adjacency_list.

File:

• src/Potentials/EmpiricalPotential.hpp (modified) (1 diff)

src/Potentials/EmpiricalPotential.hpp

@@ -86 +86 @@
   /** Provides the specific subgraph for this specific empirical potential.
    *
-   * \return subgraph encoded as boost::graph's adjacency_list
+   * \return subgraph describing the potential's bonding model
    */
-  virtual boost::adjacency_list<> getSubgraph() const=0;
+  virtual const PotentialSubgraph& getSubgraph() const=0;
 
   /** Default constructor for class EmpiricalPotential.