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Use better data structure to implement ResidueType
[alexxy/gromacs.git]
/
src
/
gromacs
/
topology
/
index.cpp
diff --git
a/src/gromacs/topology/index.cpp
b/src/gromacs/topology/index.cpp
index 6d671af2b58aa0a50d31b8bc5931cb87eb8cb907..fb738e43c51c3360059c475b09125da6583b6eed 100644
(file)
--- a/
src/gromacs/topology/index.cpp
+++ b/
src/gromacs/topology/index.cpp
@@
-562,7
+562,7
@@
void analyse(const t_atoms* atoms, t_blocka* gb, char*** gn, gmx_bool bASK, gmx_
add_grp(gb, gn, aid, "System");
/* For every residue, get a pointer to the residue type name */
- ResidueType rt;
+ ResidueType
Map
rt;
std::vector<std::string> restype;
std::vector<std::string> previousTypename;