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testsuite-parser.at@ 22d01e

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Last change on this file since 22d01e was ca331c, checked in by Frederik Heber <heber@…>, 13 years ago

Added Undo/Redo capability to SetTremoloAtomdataAction.

SetTremoloAtomdataAction may either set/append or reset the AtomData line.
TremoloParser has new functions getAtomData() and resetAtomData() along with setAtomData(), added unit test function on the triple.
TEST: Added undo and redo test to Parser/Tremolo-SetAtomData, also new reset test.

Property mode set to 100644

File size: 3.4 KB

Rev	Line
[f2230e]	1	AT_BANNER([MoleCuilder - Parser])
	2
	3
	4	# parsing mpqc
[520f93]	5	m4_include([Parser/Mpqc/testsuite-parser-mpqc-empty.at])
	6	m4_include([Parser/Mpqc/testsuite-parser-mpqc-load.at])
[c0e28c]	7	m4_include([Parser/Mpqc/testsuite-parser-mpqc-load-multiply.at])
[520f93]	8	m4_include([Parser/Mpqc/testsuite-parser-mpqc-save.at])
[f2230e]	9
[41d023]	10	# set mpqc basis, theory and maxiter
	11	m4_include([Parser/SetParameters/Mpqc/testsuite-parser-set-parameters-mpqc.at])
[770ec6]	12	m4_include([Parser/SetParameters/Mpqc/testsuite-parser-set-parameters-mpqc-none.at])
[41d023]	13	m4_include([Parser/SetParameters/Mpqc/testsuite-parser-set-parameters-mpqc-basis.at])
	14	m4_include([Parser/SetParameters/Mpqc/testsuite-parser-set-parameters-mpqc-maxiterations.at])
	15	m4_include([Parser/SetParameters/Mpqc/testsuite-parser-set-parameters-mpqc-theory.at])
	16
[f2230e]	17	# parsing pcp
[520f93]	18	m4_include([Parser/Pcp/testsuite-parser-pcp-empty.at])
	19	m4_include([Parser/Pcp/testsuite-parser-pcp-load.at])
[c0e28c]	20	m4_include([Parser/Pcp/testsuite-parser-pcp-load-multiply.at])
[e69c87]	21	m4_include([Parser/Pcp/testsuite-parser-pcp-multiple-timesteps.at])
[520f93]	22	m4_include([Parser/Pcp/testsuite-parser-pcp-save.at])
[f2230e]	23
	24	# parsing pdb
[520f93]	25	m4_include([Parser/Pdb/testsuite-parser-pdb-empty.at])
	26	m4_include([Parser/Pdb/testsuite-parser-pdb-load.at])
[c0e28c]	27	m4_include([Parser/Pdb/testsuite-parser-pdb-load-multiply.at])
[e69c87]	28	m4_include([Parser/Pdb/testsuite-parser-pdb-multiple-timesteps.at])
[520f93]	29	m4_include([Parser/Pdb/testsuite-parser-pdb-save.at])
[e69c87]	30	m4_include([Parser/Pdb/testsuite-parser-pdb-with-conects.at])
[5fa2ba]	31
[41d023]	32	# set psi3 wavefunction
[13510b]	33	m4_include([Parser/SetParameters/Psi3/testsuite-parser-set-parameters-psi3-reference.at])
[41d023]	34	m4_include([Parser/SetParameters/Psi3/testsuite-parser-set-parameters-psi3-wavefunction.at])
	35
[473237]	36	# bugfix checks
[8990879]	37	m4_include([Parser/Pdb/testsuite-parser-pdb-capital_letters_element.at])
[473237]	38	m4_include([Parser/Pdb/testsuite-parser-pdb-CONECTs_empty_space.at])
[5fa2ba]	39	m4_include([Parser/Pdb/testsuite-parser-pdb-load-various.at])
[f2230e]	40
[c0e28c]	41	# parsing psi3
[752bb4]	42	m4_include([Parser/Psi3/testsuite-parser-psi3-empty.at])
	43	m4_include([Parser/Psi3/testsuite-parser-psi3-load.at])
[c0e28c]	44	m4_include([Parser/Psi3/testsuite-parser-psi3-load-multiply.at])
[752bb4]	45	m4_include([Parser/Psi3/testsuite-parser-psi3-save.at])
	46
[f2230e]	47	# parsing tremolo
[520f93]	48	m4_include([Parser/Tremolo/testsuite-parser-tremolo-empty.at])
	49	m4_include([Parser/Tremolo/testsuite-parser-tremolo-load.at])
[c0e28c]	50	m4_include([Parser/Tremolo/testsuite-parser-tremolo-load-multiply.at])
[520f93]	51	m4_include([Parser/Tremolo/testsuite-parser-tremolo-save.at])
[5b0581]	52	m4_include([Parser/Tremolo/testsuite-parser-tremolo-save-unique_usedfields.at])
[f2230e]	53
[4217e7]	54	# parsing tremolo with .potentials
	55	m4_include([Parser/Tremolo-Potentials/testsuite-parser-tremolo-potentials.at])
[520f93]	56	m4_include([Parser/Tremolo-Potentials/testsuite-parser-tremolo-potentials-load.at])
	57	m4_include([Parser/Tremolo-Potentials/testsuite-parser-tremolo-potentials-save.at])
[4217e7]	58
[81c980b]	59	# setting tremolo's atomdata line
	60	m4_include([Parser/Tremolo-SetAtomdata/testsuite-parser-tremolo-setatomdata.at])
[ca331c]	61	m4_include([Parser/Tremolo-SetAtomdata/testsuite-parser-tremolo-resetatomdata.at])
[81c980b]	62
[531f27]	63	# writing and exttypes file
	64	m4_include([Parser/Tremolo-Exttypes/testsuite-parser-tremolo-save-selected-atoms-as-exttypes.at])
	65
[f2230e]	66	# parsing xyz
[520f93]	67	m4_include([Parser/Xyz/testsuite-parser-xyz-empty.at])
	68	m4_include([Parser/Xyz/testsuite-parser-xyz-load.at])
[c0e28c]	69	m4_include([Parser/Xyz/testsuite-parser-xyz-load-multiply.at])
[259887]	70	m4_include([Parser/Xyz/testsuite-parser-xyz-load-various.at])
[e69c87]	71	m4_include([Parser/Xyz/testsuite-parser-xyz-multiple-timesteps.at])
[520f93]	72	m4_include([Parser/Xyz/testsuite-parser-xyz-save.at])
[f2230e]	73

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