Index: tests/GuiChecks/Filling/RegularGrid/testsuite-fill-regular-grid-with-surface.at
===================================================================
--- tests/GuiChecks/Filling/RegularGrid/testsuite-fill-regular-grid-with-surface.at	(revision dd6c07d2c5d563c8e46c0a4b01a0de11563eb584)
+++ tests/GuiChecks/Filling/RegularGrid/testsuite-fill-regular-grid-with-surface.at	(revision dd6c07d2c5d563c8e46c0a4b01a0de11563eb584)
@@ -0,0 +1,72 @@
+#
+#    MoleCuilder - creates and alters molecular systems
+#    Copyright (C) 2008-2012 University of Bonn
+#
+#    This program is free software: you can redistribute it and/or modify
+#    it under the terms of the GNU General Public License as published by
+#    the Free Software Foundation, either version 3 of the License, or
+#    (at your option) any later version.
+#
+#    This program is distributed in the hope that it will be useful,
+#    but WITHOUT ANY WARRANTY; without even the implied warranty of
+#    MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE.  See the
+#    GNU General Public License for more details.
+#
+#    You should have received a copy of the GNU General Public License
+#    along with this program.  If not, see <http://www.gnu.org/licenses/>.
+#
+### fill regular grid with surface
+
+AT_SETUP([Filling - Fill regular grid with surface and no atoms])
+AT_KEYWORDS([filling fill-regular-grid add-empty-boundary])
+
+file=solved_double_sles.data
+AT_CHECK([/bin/cp -f ${abs_top_srcdir}/tests/regression/Filling/RegularGrid/pre/double_sles.data $file], 0)
+AT_CHECK([chmod u+w $file], 0)
+# check that specifying radius but selecting no atoms is wrong
+AT_CHECK([../../molecuilder --dry-run --parse-tremolo-potentials ${abs_top_srcdir}/tests/regression/Filling/RegularGrid/pre/sles.potentials -i $file -B "14.199,0,14.199,0,0,14.199" --load ${abs_top_srcdir}/tests/regression/Filling/RegularGrid/pre/water.data --select-molecule-by-order -1 --fill-regular-grid --mesh-size 5 5 5 --mesh-offset "0.5,0.5,0.5" --tesselation-radius 10 --min-distance .5 --no-dry-run --store-session session-fill-regular-grid-with-surface.py --session-type python], 0, [stdout], [stderr])
+AT_CHECK([grep -v "Command.*DryRun" session-fill-regular-grid-with-surface.py >session-fill-regular-grid-with-surface_new.py], 0, [ignore], [ignore])
+AT_CHECK([../../molecuilderguitest session-fill-regular-grid-with-surface_new.py], 5, [stdout], [stderr])
+
+AT_CLEANUP
+
+AT_SETUP([Filling - Fill regular grid with surface])
+AT_KEYWORDS([filling fill-regular-grid add-empty-boundary])
+
+file=solved_double_sles.data
+AT_CHECK([/bin/cp -f ${abs_top_srcdir}/tests/regression/Filling/RegularGrid/pre/double_sles.data $file], 0)
+AT_CHECK([chmod u+w $file], 0)
+AT_CHECK([../../molecuilder --dry-run --parse-tremolo-potentials ${abs_top_srcdir}/tests/regression/Filling/RegularGrid/pre/sles.potentials -i $file --select-all-atoms -B "14.199,0,14.199,0,0,14.199" --load ${abs_top_srcdir}/tests/regression/Filling/RegularGrid/pre/water.data --select-molecule-by-order -1 --fill-regular-grid --mesh-size 5 5 5 --mesh-offset "0.5,0.5,0.5" --tesselation-radius 10 --min-distance .5 --no-dry-run --store-session session-fill-regular-grid-with-surface.py --session-type python], 0, [stdout], [stderr])
+AT_CHECK([grep -v "Command.*DryRun" session-fill-regular-grid-with-surface.py >session-fill-regular-grid-with-surface_new.py], 0, [ignore], [ignore])
+AT_CHECK([../../molecuilderguitest session-fill-regular-grid-with-surface_new.py], 0, [stdout], [stderr])
+AT_CHECK([diff -I '.*Created by molecuilder.*' $file ${abs_top_srcdir}/tests/regression/Filling/RegularGrid/post/$file], 0, [ignore], [ignore])
+
+AT_CLEANUP
+
+
+AT_SETUP([Filling - Fill regular grid with surface with Undo])
+AT_KEYWORDS([filling fill-regular-grid undo])
+
+file=solved_double_sles.data
+AT_CHECK([/bin/cp -f ${abs_top_srcdir}/tests/regression/Filling/RegularGrid/pre/double_sles.data $file], 0)
+AT_CHECK([chmod u+w $file], 0)
+AT_CHECK([../../molecuilder --dry-run --parse-tremolo-potentials ${abs_top_srcdir}/tests/regression/Filling/RegularGrid/pre/sles.potentials -i $file --select-all-atoms -B "14.199,0,14.199,0,0,14.199" --load ${abs_top_srcdir}/tests/regression/Filling/RegularGrid/pre/water.data --select-molecule-by-order -1 --fill-regular-grid --mesh-size 5 5 5 --mesh-offset "0.5,0.5,0.5" --tesselation-radius 10 --min-distance .5 --undo --no-dry-run --store-session session-fill-regular-grid-with-surface.py --session-type python], 0, [stdout], [stderr])
+AT_CHECK([grep -v "Command.*DryRun" session-fill-regular-grid-with-surface.py >session-fill-regular-grid-with-surface_new.py], 0, [ignore], [ignore])
+AT_CHECK([../../molecuilderguitest session-fill-regular-grid-with-surface_new.py], 0, [stdout], [stderr])
+AT_CHECK([diff -I '.*Created by molecuilder.*' $file ${abs_top_srcdir}/tests/regression/Filling/RegularGrid/post/double_sles-undo.data], 0, [ignore], [ignore])
+
+AT_CLEANUP
+
+
+AT_SETUP([Filling - Fill regular grid with surface with Redo])
+AT_KEYWORDS([filling fill-regular-grid redo])
+
+file=solved_double_sles.data
+AT_CHECK([/bin/cp -f ${abs_top_srcdir}/tests/regression/Filling/RegularGrid/pre/double_sles.data $file], 0)
+AT_CHECK([chmod u+w $file], 0)
+AT_CHECK([../../molecuilder --dry-run --parse-tremolo-potentials ${abs_top_srcdir}/tests/regression/Filling/RegularGrid/pre/sles.potentials -i $file --select-all-atoms -B "14.199,0,14.199,0,0,14.199" --load ${abs_top_srcdir}/tests/regression/Filling/RegularGrid/pre/water.data --select-molecule-by-order -1 --fill-regular-grid --mesh-size 5 5 5 --mesh-offset "0.5,0.5,0.5" --tesselation-radius 10 --min-distance .5 --undo --redo --no-dry-run --store-session session-fill-regular-grid-with-surface.py --session-type python], 0, [stdout], [stderr])
+AT_CHECK([grep -v "Command.*DryRun" session-fill-regular-grid-with-surface.py >session-fill-regular-grid-with-surface_new.py], 0, [ignore], [ignore])
+AT_CHECK([../../molecuilderguitest session-fill-regular-grid-with-surface_new.py], 0, [stdout], [stderr])
+AT_CHECK([diff -I '.*Created by molecuilder.*' $file ${abs_top_srcdir}/tests/regression/Filling/RegularGrid/post/$file], 0, [ignore], [ignore])
+
+AT_CLEANUP
Index: tests/GuiChecks/Filling/RegularGrid/testsuite-fill-regular-grid.at
===================================================================
--- tests/GuiChecks/Filling/RegularGrid/testsuite-fill-regular-grid.at	(revision dd6c07d2c5d563c8e46c0a4b01a0de11563eb584)
+++ tests/GuiChecks/Filling/RegularGrid/testsuite-fill-regular-grid.at	(revision dd6c07d2c5d563c8e46c0a4b01a0de11563eb584)
@@ -0,0 +1,59 @@
+#
+#    MoleCuilder - creates and alters molecular systems
+#    Copyright (C) 2008-2012 University of Bonn
+#
+#    This program is free software: you can redistribute it and/or modify
+#    it under the terms of the GNU General Public License as published by
+#    the Free Software Foundation, either version 3 of the License, or
+#    (at your option) any later version.
+#
+#    This program is distributed in the hope that it will be useful,
+#    but WITHOUT ANY WARRANTY; without even the implied warranty of
+#    MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE.  See the
+#    GNU General Public License for more details.
+#
+#    You should have received a copy of the GNU General Public License
+#    along with this program.  If not, see <http://www.gnu.org/licenses/>.
+#
+### fill regular grid
+
+AT_SETUP([Filling - Fill regular grid])
+AT_KEYWORDS([filling fill-regular-grid add-empty-boundary])
+
+file=solved_single_sles.data
+AT_CHECK([/bin/cp -f ${abs_top_srcdir}/tests/regression/Filling/RegularGrid/pre/single_sles.data $file], 0)
+AT_CHECK([chmod u+w $file], 0)
+AT_CHECK([../../molecuilder --dry-run --parse-tremolo-potentials ${abs_top_srcdir}/tests/regression/Filling/RegularGrid/pre/sles.potentials -i $file -B "14.199,0,16.6216,0,0,33.9159" --load ${abs_top_srcdir}/tests/regression/Filling/RegularGrid/pre/water.data --select-molecule-by-order -1 --fill-regular-grid --mesh-size 5 5 11 --mesh-offset "0.5,0.5,0.5" --min-distance 3.1 --no-dry-run --store-session session-fill-regular-grid.py --session-type python], 0, [stdout], [stderr])
+AT_CHECK([grep -v "Command.*DryRun" session-fill-regular-grid.py >session-fill-regular-grid_new.py], 0, [ignore], [ignore])
+AT_CHECK([../../molecuilderguitest session-fill-regular-grid_new.py], 0, [stdout], [stderr])
+AT_CHECK([diff -I '.*Created by molecuilder.*' $file ${abs_top_srcdir}/tests/regression/Filling/RegularGrid/post/$file], 0, [ignore], [ignore])
+
+AT_CLEANUP
+
+
+AT_SETUP([Filling - Fill regular grid with Undo])
+AT_KEYWORDS([filling fill-regular-grid undo])
+
+file=solved_single_sles.data
+AT_CHECK([/bin/cp -f ${abs_top_srcdir}/tests/regression/Filling/RegularGrid/pre/single_sles.data $file], 0)
+AT_CHECK([chmod u+w $file], 0)
+AT_CHECK([../../molecuilder --dry-run --parse-tremolo-potentials ${abs_top_srcdir}/tests/regression/Filling/RegularGrid/pre/sles.potentials -i $file -B "14.199,0,16.6216,0,0,33.9159" --load ${abs_top_srcdir}/tests/regression/Filling/RegularGrid/pre/water.data --select-molecule-by-order -1 --fill-regular-grid --mesh-size 5 5 11 --mesh-offset "0.5,0.5,0.5" --min-distance 3.1 --undo --no-dry-run --store-session session-fill-regular-grid.py --session-type python], 0, [stdout], [stderr])
+AT_CHECK([grep -v "Command.*DryRun" session-fill-regular-grid.py >session-fill-regular-grid_new.py], 0, [ignore], [ignore])
+AT_CHECK([../../molecuilderguitest session-fill-regular-grid_new.py], 0, [stdout], [stderr])
+AT_CHECK([diff -I '.*Created by molecuilder.*' $file ${abs_top_srcdir}/tests/regression/Filling/RegularGrid/post/single_sles-undo.data], 0, [ignore], [ignore])
+
+AT_CLEANUP
+
+
+AT_SETUP([Filling - Fill regular grid with Redo])
+AT_KEYWORDS([filling fill-regular-grid redo])
+
+file=solved_single_sles.data
+AT_CHECK([/bin/cp -f ${abs_top_srcdir}/tests/regression/Filling/RegularGrid/pre/single_sles.data $file], 0)
+AT_CHECK([chmod u+w $file], 0)
+AT_CHECK([../../molecuilder --dry-run --parse-tremolo-potentials ${abs_top_srcdir}/tests/regression/Filling/RegularGrid/pre/sles.potentials -i $file -B "14.199,0,16.6216,0,0,33.9159" --load ${abs_top_srcdir}/tests/regression/Filling/RegularGrid/pre/water.data --select-molecule-by-order -1 --fill-regular-grid --mesh-size 5 5 11 --mesh-offset "0.5,0.5,0.5" --min-distance 3.1 --undo --redo --no-dry-run --store-session session-fill-regular-grid.py --session-type python], 0, [stdout], [stderr])
+AT_CHECK([grep -v "Command.*DryRun" session-fill-regular-grid.py >session-fill-regular-grid_new.py], 0, [ignore], [ignore])
+AT_CHECK([../../molecuilderguitest session-fill-regular-grid_new.py], 0, [stdout], [stderr])
+AT_CHECK([diff -I '.*Created by molecuilder.*' $file ${abs_top_srcdir}/tests/regression/Filling/RegularGrid/post/$file], 0, [ignore], [ignore])
+
+AT_CLEANUP
