Refactor preprocessing atom types.
[alexxy/gromacs.git] / src / gromacs / gmxpreprocess / vsite_parm.h
index 81005a0fe42df6e4e49b02251352a848031a5ac3..ec383ac64c868510a8e91833426203581305e373 100644 (file)
 
 #include "gromacs/utility/arrayref.h"
 
-struct gpp_atomtype;
+class PreprocessingAtomTypes;
 struct gmx_moltype_t;
 struct t_atoms;
 struct InteractionTypeParameters;
 
-int set_vsites(bool bVerbose, t_atoms *atoms,  gpp_atomtype *atype,
+int set_vsites(bool bVerbose, t_atoms *atoms,  PreprocessingAtomTypes *atype,
                gmx::ArrayRef<InteractionTypeParameters> plist);
 /* set parameters for virtual sites, return number of virtual sites */