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Comparing trunk/OOPSE-2.0/ChangeLog (file contents):
Revision 1594 by tim, Mon Oct 18 23:13:23 2004 UTC vs.
Revision 1648 by tim, Tue Oct 26 22:19:22 2004 UTC

# Line 1 | Line 1
1 + 2004-10-25 17:46  tim
2 +
3 +        * ChangeLog, src/math/RectMatrix.hpp, src/math/SquareMatrix.hpp,
4 +        src/math/SquareMatrix3.hpp, src/math/Vector.hpp,
5 +        src/math/Vector3.hpp, test/brains/StuntDouble.hpp,
6 +        test/math/RectMatrixTestCase.cpp, test/math/Vector3TestCase.cpp,
7 +        test/math/VectorTestCase.cpp: add getArray function to  RectMatrix
8 +        and Vector classes
9 +
10 + 2004-10-25 12:03  tim
11 +
12 +        * ChangeLog, src/utils/GenericFactory.hpp,
13 +        test/utils/GenericFactoryTestCase.cpp,
14 +        test/utils/GenericFactoryTestCase.hpp, test/utils/Makefile: adding
15 +        GenericFactory Test Case. GenericFactory now can bed used to creat
16 +        ForcefieldFactory and IntegratorFactory etc.
17 +
18 + 2004-10-24 23:08  tim
19 +
20 +        * src/: brains/SimModel.hpp, brains/SimSnapshotManager.cpp,
21 +        brains/SimSnapshotManager.hpp, brains/Snapshot.hpp,
22 +        brains/SnapshotManager.hpp, utils/GenericFactory.hpp: more classes
23 +        get reconstructed
24 +
25 + 2004-10-24 02:55  tim
26 +
27 +        * src/utils/GenericFactory.hpp: GenericFactory pass unit test
28 +
29 + 2004-10-23 18:09  tim
30 +
31 +        * test/brains/: Atom.hpp, DirectionalAtom.hpp, RigidBody.hpp,
32 +        StuntDouble.cpp, StuntDouble.hpp, Atom.cpp, DirectioanlAtom.cpp,
33 +        RigidBody.cpp: Refactoring in progress
34 +
35 + 2004-10-22 18:09  tim
36 +
37 +        * ChangeLog, src/brains/Snapshot.hpp,
38 +        src/brains/SnapshotManager.hpp, src/math/SquareMatrix.hpp,
39 +        test/brains/SnapshotTestCase.cpp, test/brains/SnapshotTestCase.hpp,
40 +        test/brains/StuntDouble.hpp: more work in Snapshot
41 +
42 + 2004-10-22 17:59  chrisfen
43 +
44 +        * src/: UseTheForce/LJFF.cpp,
45 +        UseTheForce/DarkSide/atype_interface.h, types/AtomType.cpp: Dear
46 +        god!  It runs and conserves energy!
47 +
48 + 2004-10-22 17:54  chrisfen
49 +
50 +        * src/types/: AtomType.cpp, AtomType.hpp: strDUP not strCOPY
51 +
52 + 2004-10-22 17:53  chrisfen
53 +
54 +        * src/: UseTheForce/DUFF.cpp, UseTheForce/EAM_FF.cpp,
55 +        UseTheForce/LJFF.cpp, UseTheForce/Shapes_FF.cpp,
56 +        UseTheForce/WATER.cpp, UseTheForce/doForces.F90,
57 +        brains/SimInfo.cpp, brains/SimInfo.hpp: fixey fixey the breakey
58 +        breakey
59 +
60 + 2004-10-22 17:53  chrisfen
61 +
62 +        * make/Makefile.in: compiler flags
63 +
64 + 2004-10-22 16:20  gezelter
65 +
66 +        * src/: UseTheForce/DUFF.cpp, UseTheForce/EAM_FF.cpp,
67 +        UseTheForce/LJFF.cpp, UseTheForce/doForces.F90,
68 +        brains/fSimulation.h, types/AtomType.hpp,
69 +        types/DirectionalAtomType.hpp: fixey fixey
70 +
71 + 2004-10-22 15:22  gezelter
72 +
73 +        * src/UseTheForce/DarkSide/: LJ.F90, atype.F90, atype_interface.h,
74 +        charge.F90, charge_interface.h, dipole.F90, dipole_interface.h,
75 +        lj_interface.h, shapes.F90, simulation.F90: Added un-busticated
76 +        fortran files and c/Fortran interfaces
77 +
78 + 2004-10-22 15:21  gezelter
79 +
80 +        * src/types/: AtomType.cpp, AtomType.hpp, AtomTypeProperties.h,
81 +        DirectionalAtomType.hpp, Makefile: More on AtomType and
82 +        DirectionalAtomType
83 +
84 + 2004-10-22 09:47  gezelter
85 +
86 +        * src/types/AtomType.hpp: Adding AtomType
87 +
88 + 2004-10-21 16:31  tim
89 +
90 +        * ChangeLog, src/brains/Snapshot.hpp,
91 +        src/brains/SnapshotManager.hpp, src/math/RectMatrix.hpp,
92 +        src/math/SquareMatrix.hpp, src/math/SquareMatrix3.hpp,
93 +        src/math/Vector.hpp, src/math/Vector3.hpp,
94 +        test/math/RectMatrixTestCase.cpp, test/math/VectorTestCase.cpp:
95 +        Snapshot and SnapshotManager in progress
96 +
97 + 2004-10-21 16:30  tim
98 +
99 +        * test/brains/: BrainsTest.cpp, Makefile,
100 +        SnapshotManagerTestCase.cpp, SnapshotManagerTestCase.hpp,
101 +        SnapshotTestCase.cpp, SnapshotTestCase.hpp: adding test case for
102 +        Snapshot and snapshotManager.
103 +
104 + 2004-10-21 15:15  gezelter
105 +
106 +        * src/: UseTheForce/DUFF.cpp, UseTheForce/EAM_FF.cpp,
107 +        UseTheForce/ForceFields.cpp, UseTheForce/ForceFields.hpp,
108 +        UseTheForce/LJFF.cpp, UseTheForce/Shapes_FF.cpp,
109 +        UseTheForce/WATER.cpp, UseTheForce/doForces.F90,
110 +        UseTheForce/doForces_interface.h, UseTheForce/fForceField.h,
111 +        UseTheForce/DarkSide/LJ.F90, UseTheForce/DarkSide/lj_interface.h,
112 +        brains/SimSetup.cpp, types/AtomTypeProperties.h: Breaky Breaky.  
113 +        Fixey Fixey.
114 +
115 + 2004-10-21 11:32  tim
116 +
117 +        * src/utils/GenericData.cpp, src/utils/Makefile,
118 +        test/utils/Makefile, test/utils/UtilTest: remove some junk files
119 +
120 + 2004-10-21 11:24  tim
121 +
122 +        * test/utils/GenericData.hpp: remove backup of  GenericData.hpp
123 +
124 + 2004-10-21 11:22  tim
125 +
126 +        * ChangeLog, src/brains/SimSetup.cpp,
127 +        src/constraints/ZConstraint.cpp, src/constraints/ZconsData.hpp,
128 +        src/integrators/NPT.cpp, src/integrators/NPTf.cpp,
129 +        src/integrators/NPTi.cpp, src/integrators/NPTxyz.cpp,
130 +        src/integrators/NVT.cpp, src/io/DumpReader.cpp,
131 +        src/io/InitializeFromFile.cpp, src/io/ZConsReader.cpp,
132 +        src/io/ZConsWriter.hpp, src/primitives/StuntDouble.hpp,
133 +        src/utils/GenericData.cpp, src/utils/GenericData.hpp,
134 +        src/visitors/AtomData.hpp, src/visitors/AtomVisitor.cpp,
135 +        src/visitors/AtomVisitor.hpp, src/visitors/CompositeVisitor.cpp,
136 +        src/visitors/CompositeVisitor.hpp, src/visitors/OtherVisitor.cpp,
137 +        src/visitors/OtherVisitor.hpp, src/visitors/RigidBodyVisitor.cpp,
138 +        src/visitors/RigidBodyVisitor.hpp, src/visitors/ZconsVisitor.cpp,
139 +        src/visitors/ZconsVisitor.hpp: replace old GebericData with  new
140 +        GenericData
141 +
142 + 2004-10-21 10:25  chuckv
143 +
144 +        * src/UseTheForce/DarkSide/: LJ.F90, eam.F90: Added newLJtype to lj
145 +        module.
146 +
147 + 2004-10-21 10:24  chuckv
148 +
149 +        * src/UseTheForce/DarkSide/lj_interface.h: Added interface for
150 +        fortran lj module.
151 +
152 + 2004-10-20 17:54  tim
153 +
154 +        * ChangeLog, src/utils/PropertyMap.cpp, src/utils/PropertyMap.hpp,
155 +        test/utils/GenericDataTestCase.cpp, test/utils/Makefile,
156 +        test/utils/PropertyMapTestCase.cpp,
157 +        test/utils/PropertyMapTestCase.hpp, test/utils/UtilTest:
158 +        GenericData and PropertyMap  pass unit test.
159 +
160 + 2004-10-20 16:52  gezelter
161 +
162 +        * src/UseTheForce/: DUFF.cpp, WATER.cpp, DarkSide/sticky.F90,
163 +        DarkSide/sticky_interface.h: fixed a fortran name problem
164 +
165 + 2004-10-20 16:38  tim
166 +
167 +        * test/utils/: GenericData.hpp, GenericDataTestCase.cpp,
168 +        GenericDataTestCase.hpp, Makefile, PropertyMapTestCase.hpp,
169 +        UtilTest, UtilTest.cpp: adding generic data test case
170 +
171 + 2004-10-20 16:16  chuckv
172 +
173 +        * configure, ac-tools/aclocal.m4,
174 +        src/UseTheForce/DarkSide/Makefile,
175 +        src/UseTheForce/DarkSide/mpiSimulation.F90,
176 +        src/UseTheForce/DarkSide/mpiSimulation_interface.h,
177 +        src/UseTheForce/DarkSide/simParallel.F90,
178 +        src/UseTheForce/DarkSide/simParallel_interface.h,
179 +        src/brains/mpiSimulation.cpp, src/brains/mpiSimulation.hpp:
180 +        Fortran/C++ interface de-obfuscation project appears to be
181 +        complete!  Woo hoo!
182 +
183 + 2004-10-20 15:47  chuckv
184 +
185 +        * src/UseTheForce/: fortranWrapDefines.hpp, fortranWrappers.cpp,
186 +        fortranWrappers.hpp: Fortran/C++ interface de-obfuscation project
187 +        continues
188 +
189 + 2004-10-20 15:46  chuckv
190 +
191 +        * src/: UseTheForce/DUFF.cpp, UseTheForce/EAM_FF.cpp,
192 +        UseTheForce/ForceFields.cpp, UseTheForce/ForceFields.hpp,
193 +        UseTheForce/LJFF.cpp, UseTheForce/Makefile, UseTheForce/WATER.cpp,
194 +        UseTheForce/doForces_interface.h,
195 +        UseTheForce/notifyCutoffs_interface.h, UseTheForce/wrappers.F90,
196 +        UseTheForce/DarkSide/atype_interface.h,
197 +        UseTheForce/DarkSide/eam_interface.h,
198 +        UseTheForce/DarkSide/gb_interface.h,
199 +        UseTheForce/DarkSide/mpiSimulation_interface.h,
200 +        UseTheForce/DarkSide/shapes_interface.h,
201 +        UseTheForce/DarkSide/simulation_interface.h,
202 +        UseTheForce/DarkSide/sticky_interface.h, brains/ForceFields.cpp,
203 +        brains/SimInfo.cpp, brains/SimInfo.hpp: Fortran/C++ interface
204 +        de-obfuscation project (It is a very long story)
205 +
206 + 2004-10-20 13:07  tim
207 +
208 +        * ChangeLog, src/math/SquareMatrix.hpp, src/math/SquareMatrix3.hpp,
209 +        test/math/SquareMatrix3TestCase.cpp,
210 +        test/math/SquareMatrixTestCase.cpp,
211 +        test/math/SquareMatrixTestCase.hpp: Math library pass the unit test
212 +
213 + 2004-10-20 00:52  tim
214 +
215 +        * src/brains/: Snapshot.hpp, SnapshotManager.hpp: Snapshot and
216 +        SnapshotManager in design phase
217 +
218 + 2004-10-19 23:54  gezelter
219 +
220 +        * src/: brains/SimSetup.cpp, utils/StringUtils.cpp: namespace
221 +        problem prevented linking
222 +
223 + 2004-10-19 23:54  gezelter
224 +
225 +        * src/UseTheForce/Shapes_FF.cpp: fixed include
226 +
227 + 2004-10-19 23:26  gezelter
228 +
229 +        * src/utils/: Makefile, definitions.F90, definitions_module.F90,
230 +        oopseMPI.F90, oopseMPI_module.F90, status.F90, status_module.F90:
231 +        more fortran name mangling
232 +
233 + 2004-10-19 23:23  gezelter
234 +
235 +        * src/profiling/timing.F90: yet more fortran renaming
236 +
237 + 2004-10-19 23:19  gezelter
238 +
239 +        * src/UseTheForce/: Makefile, doForces.F90, doForces_interface.h,
240 +        do_Forces.F90, do_Forces.h, notifyCutoffs.F90,
241 +        notifyCutoffs_interface.h, notifycutoffs_module_interface.h,
242 +        wrappers.F90: Fortran name cleanup continues
243 +
244 + 2004-10-19 23:12  gezelter
245 +
246 +        * src/UseTheForce/DarkSide/: atype.F90, simulation.F90: fixing some
247 +        broken fortran stuff
248 +
249 + 2004-10-19 23:02  gezelter
250 +
251 +        * src/UseTheForce/DarkSide/: LJ.F90, Makefile, atype.F90,
252 +        atype_interface.h, atype_module.F90, atype_module_interface.h,
253 +        calc_LJ_FF.F90, calc_charge_charge.F90, calc_dipole_dipole.F90,
254 +        calc_eam.F90, calc_gb.F90, calc_reaction_field.F90,
255 +        calc_shapes.F90, calc_sticky_pair.F90, charge.F90, dipole.F90,
256 +        eam.F90, eam_interface.h, eam_module_inteface.h, gb.F90,
257 +        gb_interface.h, gb_module_interface.h, mpiSimulation.F90,
258 +        mpiSimulation_interface.h, mpiSimulation_module.F90,
259 +        mpisimulation_module_interface.h, reactionField.F90, shapes.F90,
260 +        shapes_interface.h, shapes_module.h, simulation.F90,
261 +        simulation_interface.h, simulation_module.F90,
262 +        simulation_module_interface.h, sticky.F90, sticky_interface.h,
263 +        sticky_pair_module_interface.h, switch_module.F90, switcheroo.F90:
264 +        name sanity on the fortran side
265 +
266 + 2004-10-19 19:18  tim
267 +
268 +        * test/math/SquareMatrix3TestCase.hpp: [no log message]
269 +
270 + 2004-10-19 18:01  tim
271 +
272 +        * src/math/RectMatrix.hpp, src/math/SquareMatrix.hpp,
273 +        src/math/SquareMatrix3.hpp, test/math/SquareMatrix3TestCase.cpp:
274 +        except diagonalize(), all of functions in math library pass the
275 +        test
276 +
277 + 2004-10-19 17:43  chuckv
278 +
279 +        * src/UseTheForce/do_Forces.h: Added correct prototypes for
280 +        C-fortran interface functions.
281 +
282 + 2004-10-19 17:37  chuckv
283 +
284 +        * src/UseTheForce/DarkSide/: atype_module_interface.h,
285 +        eam_module_inteface.h, gb_module_interface.h,
286 +        mpisimulation_module_interface.h, simulation_module_interface.h,
287 +        sticky_pair_module_interface.h: Added correct prototypes for
288 +        C-fortran interface functions.
289 +
290 + 2004-10-19 16:28  tim
291 +
292 +        * ChangeLog, src/math/Quaternion.hpp, src/math/RectMatrix.hpp,
293 +        src/math/SquareMatrix.hpp, src/math/Vector.hpp,
294 +        test/math/QuaternionTestCase.cpp, test/math/QuaternionTestCase.hpp,
295 +        test/math/RectMatrixTestCase.cpp,
296 +        test/math/SquareMatrix3TestCase.cpp, test/math/Vector3TestCase.cpp,
297 +        test/math/Vector3TestCase.hpp, test/math/VectorTestCase.cpp: more
298 +        bugs get fixed at math library
299 +
300 + 2004-10-19 15:43  chuckv
301 +
302 +        * src/UseTheForce/: DarkSide/atype_module_interface.h,
303 +        DarkSide/eam_module_inteface.h, DarkSide/gb_module_interface.h,
304 +        DarkSide/mpisimulation_module_interface.h,
305 +        DarkSide/simulation_module_interface.h,
306 +        DarkSide/sticky_pair_module_interface.h, DarkSide/calc_eam.F90,
307 +        DarkSide/atype_module.F90, DarkSide/calc_gb.F90,
308 +        DarkSide/calc_sticky_pair.F90, DarkSide/mpiSimulation_module.F90,
309 +        DarkSide/simulation_module.F90, do_Forces.F90,
310 +        fortranWrapDefines.hpp, mpiComponentPlan.h, notifyCutoffs.F90,
311 +        notifycutoffs_module_interface.h: Added new files for fortran
312 +        interface.
313 +
314 + 2004-10-19 15:43  gezelter
315 +
316 +        * src/UseTheForce/Makefile: regressing
317 +
318 + 2004-10-19 15:40  gezelter
319 +
320 +        * src/: UseTheForce/DarkSide/calc_shapes.F90,
321 +        UseTheForce/DarkSide/shapes_module.h, utils/StringUtils.cpp:
322 +        working on shapes for portability
323 +
324 + 2004-10-19 15:40  gezelter
325 +
326 +        * src/UseTheForce/: Makefile, Shapes_FF.cpp: working on shapes
327 +
328 + 2004-10-19 13:21  chrisfen
329 +
330 +        * src/utils/: StringUtils.cpp, StringUtils.hpp: changed around
331 +        findBegin
332 +
333 + 2004-10-18 23:34  tim
334 +
335 +        * src/math/Vector.hpp, test/math/RectMatrixTestCase.cpp: more bugs
336 +        are fixed in Vector class
337 +
338 + 2004-10-18 23:28  tim
339 +
340 +        * test/math/: RectMatrixTestCase.cpp, RectMatrixTestCase.hpp: fix
341 +        some bugs in RectMatrixTestCase
342 +
343 + 2004-10-18 23:21  tim
344 +
345 +        * src/math/Vector.hpp, test/math/RectMatrixTestCase.cpp,
346 +        test/math/RectMatrixTestCase.hpp, test/math/Vector3TestCase.cpp,
347 +        test/math/Vector3TestCase.hpp, test/math/VectorTestCase.cpp,
348 +        test/math/VectorTestCase.hpp: implement more test cases
349 +
350 + 2004-10-18 18:13  tim
351 +
352 +        * ChangeLog, make/Doxyfile, src/math/Matrix3x3d.hpp,
353 +        src/math/RectMatrix.hpp, src/math/SquareMatrix.hpp,
354 +        src/math/SquareMatrix3.hpp, src/math/Vector.hpp,
355 +        src/utils/StringTokenizer.hpp, test/math/Makefile,
356 +        test/math/VectorTestCase.cpp, test/math/VectorTestCase.hpp: more
357 +        tests on math library
358 +
359 + 2004-10-18 16:03  tim
360 +
361 +        * test/math/: Makefile, QuaternionTestCase.cpp,
362 +        QuaternionTestCase.hpp, RectMatrixTestCase.cpp,
363 +        SquareMatrix3TestCase.cpp, Vector3TestCase.cpp,
364 +        Vector3TestCase.hpp, VectorTestCase.cpp, VectorTestCase.hpp: adding
365 +        more testing units
366 +
367 + 2004-10-18 12:07  tim
368 +
369 +        * src/: brains/SimSetup.hpp, io/FileReader.hpp, math/Euler3.cpp,
370 +        math/Euler3.hpp, math/Quaternion.hpp, math/SquareMatrix3.hpp,
371 +        math/Vector3.hpp, types/ShapeType.cpp, types/ShapeType.hpp,
372 +        utils/GenericFactory.hpp: fix some bugs in Quaternion class
373 +
374 + 2004-10-18 11:30  gezelter
375 +
376 +        * src/math/: RealSphericalHarmonic.cpp, RealSphericalHarmonic.hpp:
377 +        Your basic run of the mill real-valued versions of Y_l^m(\theta,
378 +        \phi)
379 +
380 + 2004-10-18 11:29  gezelter
381 +
382 +        * src/: math/Makefile, math/Matrix3x3d.hpp, math/Vector3.hpp,
383 +        types/Makefile, types/ShapeType.cpp, types/ShapeType.hpp,
384 +        utils/StringUtils.cpp, utils/StringUtils.hpp: Working on getting
385 +        Shapes into OOPSE
386 +
387 + 2004-10-18 10:21  gezelter
388 +
389 +        * src/types/: ShapeType.cpp, ShapeType.hpp: Added ShapeType
390 +
391 + 2004-10-18 00:23  tim
392 +
393 +        * test/math/VectorTestCase.hpp: adding  vector test case
394 +
395 + 2004-10-18 00:23  tim
396 +
397 +        * src/utils/GenericFactory.hpp: adding generic factory and vector
398 +        test case
399 +
400   2004-10-16 20:19  tim
401  
402          * src/math/: Quaternion.hpp, RectMatrix.hpp, SquareMatrix.hpp,
# Line 361 | Line 760
760  
761   2004-09-29 12:56  gezelter
762  
763 <        * make/: Make.conf.in, Makefile.in, _files/style.css: Working on
365 <        make stuff
763 >        * make/: Make.conf.in, Makefile.in: Working on make stuff
764  
765   2004-09-29 12:46  tim
766  
# Line 628 | Line 1026
1026          src/visitors/OtherVisitor.cpp, src/visitors/OtherVisitor.hpp,
1027          src/visitors/RigidBodyVisitor.cpp,
1028          src/visitors/RigidBodyVisitor.hpp, src/visitors/ZconsVisitor.cpp,
1029 <        src/visitors/ZconsVisitor.hpp, make/Makefile,
632 <        make/_files/style.css, samples/Makefile.in,
1029 >        src/visitors/ZconsVisitor.hpp, make/Makefile, samples/Makefile.in,
1030          samples/metals/Au-Core-Ag-Shell_Nanoparticle.in,
1031          samples/metals/Au-Core-Ag-Shell_Nanoparticle.md,
1032          samples/metals/Au_bulk_FBD.md, samples/metals/Au_bulk_voter.md,
# Line 804 | Line 1201
1201          src/visitors/OtherVisitor.cpp, src/visitors/OtherVisitor.hpp,
1202          src/visitors/RigidBodyVisitor.cpp,
1203          src/visitors/RigidBodyVisitor.hpp, src/visitors/ZconsVisitor.cpp,
1204 <        src/visitors/ZconsVisitor.hpp, make/Makefile,
808 <        make/_files/style.css, samples/Makefile.in,
1204 >        src/visitors/ZconsVisitor.hpp, make/Makefile, samples/Makefile.in,
1205          samples/metals/Au-Core-Ag-Shell_Nanoparticle.in,
1206          samples/metals/Au-Core-Ag-Shell_Nanoparticle.md,
1207          samples/metals/Au_bulk_FBD.md, samples/metals/Au_bulk_voter.md,

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