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Add DSSP v4 support to do_dssp
[alexxy/gromacs.git]
/
api
/
legacy
/
include
/
gromacs
/
fileio
/
pdbio.h
diff --git
a/api/legacy/include/gromacs/fileio/pdbio.h
b/api/legacy/include/gromacs/fileio/pdbio.h
index c34562e095dd86d4fb0b72a812bd668e0cabf6fd..87da7ead73d50d90fee4952680eb131f5ee33bec 100644
(file)
--- a/
api/legacy/include/gromacs/fileio/pdbio.h
+++ b/
api/legacy/include/gromacs/fileio/pdbio.h
@@
-107,7
+107,8
@@
void write_pdbfile_indexed(FILE* out,
int nindex,
const int index[],
gmx_conect conect,
- bool usePqrFormat);
+ bool usePqrFormat,
+ bool standardCompliantMode = false);
/* REALLY low level */
void write_pdbfile(FILE* out,