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root/OpenMD/branches/development/src/applications/dump2Xyz/Dump2XYZ.cpp
Revision 1850 - (view) (annotate) - [select for diffs]
Modified Wed Feb 20 15:39:39 2013 UTC (12 years, 2 months ago) by gezelter
File length: 9894 byte(s)
Diff to previous 1769
Fixed a widespread typo in the license 

Revision 1769 - (view) (annotate) - [select for diffs]
Modified Mon Jul 9 14:15:52 2012 UTC (12 years, 9 months ago) by gezelter
File length: 9893 byte(s)
Diff to previous 1725
Code readability updates.

Revision 1725 - (view) (annotate) - [select for diffs]
Modified Sat May 26 18:13:43 2012 UTC (12 years, 11 months ago) by gezelter
File length: 10109 byte(s)
Diff to previous 1706
Individual ForceField classes have been removed (they were essentially
all duplicates anyway).  

ForceField has moved to brains, and since only one force field is in
play at any time, the ForceFieldFactory and Register methods have been
removed.  


Revision 1706 - (view) (annotate) - [select for diffs]
Modified Fri Apr 27 20:44:16 2012 UTC (13 years ago) by gezelter
File length: 10163 byte(s)
Diff to previous 1665
fixed an initialization bug in Dump2XYZ

Revision 1665 - (view) (annotate) - [select for diffs]
Modified Tue Nov 22 20:38:56 2011 UTC (13 years, 5 months ago) by gezelter
File length: 10153 byte(s)
Diff to previous 1629
updated copyright notices

Revision 1629 - (view) (annotate) - [select for diffs]
Modified Wed Sep 14 21:15:17 2011 UTC (13 years, 7 months ago) by gezelter
File length: 10087 byte(s)
Diff to previous 1465
Merging changes from old branch into development branch

Revision 1465 - (view) (annotate) - [select for diffs]
Modified Fri Jul 9 23:08:25 2010 UTC (14 years, 9 months ago) by chuckv
File length: 9811 byte(s)
Diff to previous 1464
Creating busticated version of OpenMD
Revision 1464 - (view) (annotate) - [select for diffs]
Modified Fri Jul 9 19:29:05 2010 UTC (14 years, 9 months ago) by gezelter
Original Path: trunk/src/applications/dump2Xyz/Dump2XYZ.cpp
File length: 9811 byte(s)
Diff to previous 1456
removing cruft (atom numbers, do_pot, do_stress) from many modules and
force managers

Revision 1456 - (view) (annotate) - [select for diffs]
Modified Fri Jun 25 17:40:24 2010 UTC (14 years, 10 months ago) by gezelter
Original Path: trunk/src/applications/dump2Xyz/Dump2XYZ.cpp
File length: 9822 byte(s)
Diff to previous 1455
more changes to make Dump2XYZ do velocities & forces

Revision 1455 - (view) (annotate) - [select for diffs]
Modified Thu Jun 24 20:44:18 2010 UTC (14 years, 10 months ago) by gezelter
Original Path: trunk/src/applications/dump2Xyz/Dump2XYZ.cpp
File length: 8909 byte(s)
Diff to previous 1442
Updating visitor architecture to something a bit more modern

Revision 1442 - (view) (annotate) - [select for diffs]
Modified Mon May 10 17:28:26 2010 UTC (14 years, 11 months ago) by gezelter
Original Path: trunk/src/applications/dump2Xyz/Dump2XYZ.cpp
File length: 9502 byte(s)
Diff to previous 1390
Adding property set to svn entries

Revision 1390 - (view) (annotate) - [select for diffs]
Modified Wed Nov 25 20:02:06 2009 UTC (15 years, 5 months ago) by gezelter
Original Path: trunk/src/applications/dump2Xyz/Dump2XYZ.cpp
File length: 9502 byte(s)
Diff to previous 1303
Almost all of the changes necessary to create OpenMD out of our old
project (OOPSE-4)

Revision 1303 - (view) (annotate) - [select for diffs]
Modified Mon Oct 13 21:35:22 2008 UTC (16 years, 6 months ago) by cli2
Original Path: trunk/src/applications/dump2Xyz/Dump2XYZ.cpp
File length: 9460 byte(s)
Diff to previous 1283
Fixes for Inversions for use with Amber

Revision 1283 - (view) (annotate) - [select for diffs]
Modified Wed Jul 30 18:48:01 2008 UTC (16 years, 9 months ago) by gezelter
Original Path: trunk/src/applications/dump2Xyz/Dump2XYZ.cpp
File length: 9284 byte(s)
Diff to previous 1282
fixed a spurious visitor deletion

Revision 1282 - (view) (annotate) - [select for diffs]
Modified Wed Jul 30 18:11:19 2008 UTC (16 years, 9 months ago) by gezelter
Original Path: trunk/src/applications/dump2Xyz/Dump2XYZ.cpp
File length: 9306 byte(s)
Diff to previous 1212
Many fixes

Revision 1212 - (view) (annotate) - [select for diffs]
Modified Wed Jan 23 21:21:13 2008 UTC (17 years, 3 months ago) by xsun
Original Path: trunk/src/applications/dump2Xyz/Dump2XYZ.cpp
File length: 9318 byte(s)
Diff to previous 1117
Added a few visitors

Revision 1117 - (view) (annotate) - [select for diffs]
Modified Tue Jan 16 22:17:27 2007 UTC (18 years, 3 months ago) by chuckv
Original Path: trunk/src/applications/dump2Xyz/Dump2XYZ.cpp
File length: 9088 byte(s)
Diff to previous 1026
Added printPosOnly to Dump2XYZ as a userbase(BETH) request.

Revision 1026 - (view) (annotate) - [select for diffs]
Modified Wed Aug 30 21:04:04 2006 UTC (18 years, 8 months ago) by gezelter
Original Path: trunk/src/applications/dump2Xyz/Dump2XYZ.cpp
File length: 8984 byte(s)
Diff to previous 968
Changing utility programs to use the new file format

Revision 968 - (view) (annotate) - [select for diffs]
Modified Tue May 23 18:46:11 2006 UTC (18 years, 11 months ago) by tim
Original Path: trunk/src/applications/dump2Xyz/Dump2XYZ.cpp
File length: 9111 byte(s)
Diff to previous 954
wrapping back to PBC by molecule instead of by individual atom

Revision 954 - (view) (annotate) - [select for diffs]
Modified Wed May 10 01:44:48 2006 UTC (18 years, 11 months ago) by tim
Original Path: trunk/src/applications/dump2Xyz/Dump2XYZ.cpp
File length: 8331 byte(s)
Diff to previous 881
adding a gay-berne switch to Dump2XYZ

Revision 881 - (view) (annotate) - [select for diffs]
Modified Thu Feb 2 15:49:42 2006 UTC (19 years, 3 months ago) by xsun
Original Path: trunk/src/applications/dump2Xyz/Dump2XYZ.cpp
File length: 8241 byte(s)
Diff to previous 543
Adding visitor for GBlipid atom type

Revision 543 - (view) (annotate) - [select for diffs]
Modified Thu May 26 22:45:00 2005 UTC (19 years, 11 months ago) by tim
Original Path: trunk/src/applications/dump2Xyz/Dump2XYZ.cpp
File length: 8118 byte(s)
Diff to previous 527
adding AtomNameVisitor to convert atom name to its base name; wrappingvisitor
now wrap back to the center of the mass; adding P2OrderParameter into StaticProps

Revision 527 - (view) (annotate) - [select for diffs]
Modified Thu May 12 19:43:48 2005 UTC (19 years, 11 months ago) by chrisfen
Original Path: trunk/src/applications/dump2Xyz/Dump2XYZ.cpp
File length: 7913 byte(s)
Diff to previous 507
Couple of changes for TAP water.  Need to parametrize.

Revision 507 - (view) (annotate) - [select for diffs]
Modified Fri Apr 15 22:04:00 2005 UTC (20 years ago) by gezelter
Original Path: trunk/src/applications/dump2Xyz/Dump2XYZ.cpp
File length: 7904 byte(s)
Diff to previous 466
xemacs has been drafted to perform our indentation services

Revision 466 - (view) (annotate) - [select for diffs]
Modified Mon Apr 11 20:54:53 2005 UTC (20 years ago) by tim
Original Path: trunk/src/applications/dump2Xyz/Dump2XYZ.cpp
File length: 7905 byte(s)
Diff to previous 413
forget to delete prepareVisitor in Dump2XYZ

Revision 413 - (view) (annotate) - [select for diffs]
Modified Wed Mar 9 17:30:29 2005 UTC (20 years, 1 month ago) by tim
Original Path: trunk/src/applications/dump2Xyz/Dump2XYZ.cpp
File length: 7882 byte(s)
Diff to previous 381
adding IndexFinder which is used to select the molecules; Seperate ElectrostaticAtomTypesSectionParser into
ChargeAtomTypesSectionParser and MultipoleAtomTypesSectionParser;remove print dipole option from Dump2XYZ;

Revision 381 - (view) (annotate) - [select for diffs]
Modified Tue Mar 1 14:45:45 2005 UTC (20 years, 2 months ago) by tim
Original Path: trunk/src/applications/dump2Xyz/Dump2XYZ.cpp
File length: 9324 byte(s)
Diff to previous 369
adding MersenneTwister random number generator

Revision 369 - (view) (annotate) - [select for diffs]
Modified Fri Feb 18 23:07:32 2005 UTC (20 years, 2 months ago) by tim
Original Path: trunk/src/applications/dump2Xyz/Dump2XYZ.cpp
File length: 9324 byte(s)
Diff to previous 324
adding LipidTransVisitor, GofXyz is working now

Revision 324 - (view) (annotate) - [select for diffs]
Modified Sun Feb 13 19:10:25 2005 UTC (20 years, 2 months ago) by tim
Original Path: trunk/src/applications/dump2Xyz/Dump2XYZ.cpp
File length: 8894 byte(s)
Diff to previous 294
dynamicProps get built

Revision 294 - (view) (annotate) - [select for diffs]
Modified Fri Feb 4 22:46:10 2005 UTC (20 years, 2 months ago) by tim
Original Path: trunk/src/applications/dump2Xyz/Dump2XYZ.cpp
File length: 8852 byte(s)
Diff to previous 291
remove SelectionVisitor

Revision 291 - (view) (annotate) - [select for diffs]
Modified Fri Feb 4 22:43:54 2005 UTC (20 years, 2 months ago) by tim
Original Path: trunk/src/applications/dump2Xyz/Dump2XYZ.cpp
File length: 8893 byte(s)
Diff to previous 273
dump2Xyz now take advantage of selection library

Revision 273 - (view) (annotate) - [select for diffs]
Modified Tue Jan 25 17:45:23 2005 UTC (20 years, 3 months ago) by tim
Original Path: trunk/src/applications/dump2Xyz/Dump2XYZ.cpp
File length: 8104 byte(s)
Diff to previous 250
(1) complete section parser's error message
(2) add GhostTorsion
(3) accumulate inertial tensor from the directional atoms before calculate rigidbody's inertial tensor

Revision 250 - (view) (annotate) - [select for diffs]
Modified Wed Jan 12 23:21:42 2005 UTC (20 years, 3 months ago) by tim
Original Path: trunk/src/applications/dump2Xyz/Dump2XYZ.cpp
File length: 8099 byte(s)
Diff to previous 246
minor fix

Revision 246 - (view) (annotate) - [select for diffs]
Modified Wed Jan 12 22:41:40 2005 UTC (20 years, 3 months ago) by gezelter
Original Path: trunk/src/applications/dump2Xyz/Dump2XYZ.cpp
File length: 8095 byte(s)
Diff to previous 211
merging new_design branch into OOPSE-2.0

Revision 211 - (view) (annotate) - [select for diffs]
Modified Fri Nov 5 21:45:14 2004 UTC (20 years, 5 months ago) by chrisfen
Original Path: trunk/src/applications/dump2Xyz/Dump2XYZ.cpp
File length: 5919 byte(s)
Diff to previous 12
Added the linear visitor

Revision 12 - (view) (annotate) - [select for diffs]
Added Tue Sep 28 23:24:25 2004 UTC (20 years, 7 months ago) by tim
Original Path: trunk/src/applications/dump2Xyz/Dump2XYZ.cpp
File length: 5784 byte(s)
change directory structure of application. Every executable file is replaced in seperate directory

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