Remove cell_{get,set}_pointgroup() from API

3 files changed, 4 insertions, 25 deletions

diff --git a/libcrystfel/src/cell-utils.c b/libcrystfel/src/cell-utils.c
index 1bc937f9..a49f75fe 100644
--- a/libcrystfel/src/cell-utils.c
+++ b/libcrystfel/src/cell-utils.c
@@ -224,14 +224,14 @@ void cell_print(UnitCell *cell)
 
 	if ( cell_has_parameters(cell) ) {
 		if ( right_handed(cell) ) {
-			STATUS(", right handed");
+			STATUS(", right handed.\n");
 		} else {
-			STATUS(", left handed");
+			STATUS(", left handed.\n");
 		}
+	} else {
+		STATUS(".\n");
 	}
 
-	STATUS(", point group '%s'.\n", cell_get_pointgroup(cell));
-
 	if ( cell_has_parameters(cell) ) {
 		cell_get_parameters(cell, &a, &b, &c, &alpha, &beta, &gamma);
 
@@ -1135,7 +1135,6 @@ UnitCell *load_cell_from_pdb(const char *filename)
 			if ( strlen(line) > 65 ) {
 				cell_set_centering(cell, line[55]);
 			} else {
-				cell_set_pointgroup(cell, "1");
 				ERROR("CRYST1 line without centering.\n");
 			}
 
diff --git a/libcrystfel/src/cell.c b/libcrystfel/src/cell.c
index 490a80ac..0dfeaa1e 100644
--- a/libcrystfel/src/cell.c
+++ b/libcrystfel/src/cell.c
@@ -93,7 +93,6 @@ struct _unitcell {
 	double ays;	double bys;	double cys;
 	double azs;	double bzs;	double czs;
 
-	char        *pointgroup;
 	LatticeType  lattice_type;
 	char         centering;
 	char         unique_axis;
@@ -127,7 +126,6 @@ UnitCell *cell_new()
 
 	cell->rep = CELL_REP_CRYST;
 
-	cell->pointgroup = strdup("1");
 	cell->lattice_type = L_TRICLINIC;
 	cell->centering = 'P';
 	cell->unique_axis = '?';
@@ -150,7 +148,6 @@ UnitCell *cell_new()
 void cell_free(UnitCell *cell)
 {
 	if ( cell == NULL ) return;
-	free(cell->pointgroup);
 	free(cell);
 }
 
@@ -298,7 +295,6 @@ UnitCell *cell_new_from_cell(UnitCell *orig)
 
 	cell_get_cartesian(orig, &ax, &ay, &az, &bx, &by, &bz, &cx, &cy, &cz);
 	cell_set_cartesian(new, ax, ay, az, bx, by, bz, cx, cy, cz);
-	cell_set_pointgroup(new, orig->pointgroup);
 	cell_set_lattice_type(new, orig->lattice_type);
 	cell_set_centering(new, orig->centering);
 	cell_set_unique_axis(new, orig->unique_axis);
@@ -323,13 +319,6 @@ void cell_set_reciprocal(UnitCell *cell,
 }
 
 
-void cell_set_pointgroup(UnitCell *cell, const char *sym)
-{
-	free(cell->pointgroup);
-	cell->pointgroup = strdup(sym);
-}
-
-
 void cell_set_centering(UnitCell *cell, char centering)
 {
 	cell->centering = centering;
@@ -622,12 +611,6 @@ int cell_get_reciprocal(UnitCell *cell,
 }
 
 
-const char *cell_get_pointgroup(UnitCell *cell)
-{
-	return cell->pointgroup;
-}
-
-
 char cell_get_centering(UnitCell *cell)
 {
 	return cell->centering;
diff --git a/libcrystfel/src/cell.h b/libcrystfel/src/cell.h
index eecf6007..919933b7 100644
--- a/libcrystfel/src/cell.h
+++ b/libcrystfel/src/cell.h
@@ -130,7 +130,6 @@ extern void cell_set_parameters(UnitCell *cell, double a, double b, double c,
 extern void cell_set_cartesian_a(UnitCell *cell, double ax, double ay, double az);
 extern void cell_set_cartesian_b(UnitCell *cell, double bx, double by, double bz);
 extern void cell_set_cartesian_c(UnitCell *cell, double cx, double cy, double cz);
-extern void cell_set_pointgroup(UnitCell *cell, const char *sym);
 
 
 extern int cell_get_parameters(UnitCell *cell, double *a, double *b, double *c,
@@ -151,8 +150,6 @@ extern void cell_set_reciprocal(UnitCell *cell,
                                 double bsx, double bsy, double bsz,
                                 double csx, double csy, double csz);
 
-extern const char *cell_get_pointgroup(UnitCell *cell);
-
 extern LatticeType cell_get_lattice_type(UnitCell *cell);
 extern void cell_set_lattice_type(UnitCell *cell, LatticeType lattice_type);