Sort all includes in src/gromacs

[alexxy/gromacs.git] / src / gromacs / gmxpreprocess / genhydro.h

diff --git a/src/gromacs/gmxpreprocess/genhydro.h b/src/gromacs/gmxpreprocess/genhydro.h
index f28f5c25309df3743de2b136107ed864d3d5e379..9161a33324d63b8786358f7ed2b5ca285818a0d5 100644 (file)
--- a/src/gromacs/gmxpreprocess/genhydro.h
+++ b/src/gromacs/gmxpreprocess/genhydro.h
@@ -39,7 +39,7 @@
 #define GMX_GMXPREPROCESS_GENHYDRO_H
 
 #include "gromacs/fileio/pdbio.h"
-#include "hackblock.h"
+#include "gromacs/gmxpreprocess/hackblock.h"
 
 #ifdef __cplusplus
 extern "C" {
@@ -65,7 +65,7 @@ int add_h(t_atoms **pdbaptr, rvec *xptr[],
  */
 
 int protonate(t_atoms **atoms, rvec **x, t_protonate *protdata);
-/* Protonate molecule according to gmx2.ff/aminoacids.hdb
+/* Protonate molecule according to oplsaa.ff/aminoacids.hdb
  * when called the first time, new atoms are added to atoms,
  * second time only coordinates are generated
  * return the new total number of atoms