Revision
1938 -
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Modified
Thu Oct 31 15:32:17 2013 UTC
(11 years, 6 months ago)
by
gezelter
File length: 21430 byte(s)
Diff to
previous 1897
Some MPI include re-ordering to work with the Intel MPI implementation.
Revision
1897 -
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Modified
Wed Jul 3 20:21:00 2013 UTC
(11 years, 9 months ago)
by
gezelter
File length: 21430 byte(s)
Diff to
previous 1879
Fixing a DumpReader bug (I think) for site data on integrable objects that are not RigidBodies.
Revision
1796 -
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Modified
Mon Sep 10 18:38:44 2012 UTC
(12 years, 7 months ago)
by
gezelter
File length: 21345 byte(s)
Diff to
previous 1793
Updating MPI calls to C++, fixing a DumpWriter bug, cleaning cruft
Revision
1610 -
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Modified
Fri Aug 12 14:37:25 2011 UTC
(13 years, 8 months ago)
by
gezelter
File length: 17375 byte(s)
Diff to
previous 1450
Fixed a clang compilation problem, added the ability to output
particle potential in the dump files.
Revision
1450 -
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Modified
Thu Jun 17 19:11:37 2010 UTC
(14 years, 10 months ago)
by
gezelter
File length: 17167 byte(s)
Diff to
previous 1442
Added tests to make sure requisite position & orientation information
are present in dump file.
Revision
1390 -
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Modified
Wed Nov 25 20:02:06 2009 UTC
(15 years, 5 months ago)
by
gezelter
File length: 16321 byte(s)
Diff to
previous 1313
Almost all of the changes necessary to create OpenMD out of our old
project (OOPSE-4)
Revision
1313 -
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Modified
Wed Oct 22 20:01:49 2008 UTC
(16 years, 6 months ago)
by
gezelter
File length: 16317 byte(s)
Diff to
previous 1249
General bug-fixes and other changes to make particle pots work with
the Helfand Energy correlation function
Revision
1241 -
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Modified
Fri Apr 25 15:14:47 2008 UTC
(17 years ago)
by
gezelter
File length: 16223 byte(s)
Diff to
previous 1112
A bunch of minor changes to make MPI compilation faster than
the double compilation we do now...
Revision
1112 -
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Modified
Wed Jan 3 20:47:00 2007 UTC
(18 years, 3 months ago)
by
chuckv
File length: 16219 byte(s)
Diff to
previous 1104
Changes to add thetacorr to dynamic props and fixes to radial rcorr.
Revision
1104 -
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Modified
Fri Dec 29 21:43:18 2006 UTC
(18 years, 4 months ago)
by
gezelter
File length: 16121 byte(s)
Diff to
previous 1037
Adding the ability to compute Center of Mass properties on
reading in a dump file. DumpReader must be told if it needs
to do this, however.
Revision
1037 -
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Modified
Fri Sep 8 16:13:21 2006 UTC
(18 years, 7 months ago)
by
gezelter
File length: 15805 byte(s)
Diff to
previous 1025
fixed a DumpReader bug, took out extra printing statements in
residentMem and BlockSnapshotManager
Revision
1025 -
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Modified
Wed Aug 30 20:33:44 2006 UTC
(18 years, 8 months ago)
by
gezelter
File length: 15787 byte(s)
Diff to
previous 1024
fixed some bugs in DumpWriter, eliminated some extra printing of
debugging information
Revision
1024 -
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Modified
Wed Aug 30 18:42:29 2006 UTC
(18 years, 8 months ago)
by
tim
File length: 15818 byte(s)
Diff to
previous 996
Massive changes preparing for release of OOPSE-4: The main difference
is that the new MD file format (.md, .dump, .eor) now contains meta-data
information along with the configuration information.
Revision
996 -
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Modified
Wed Jun 28 14:35:14 2006 UTC
(18 years, 10 months ago)
by
chrisfen
File length: 19385 byte(s)
Diff to
previous 984
more efficient file reading for thermodynamic integration, and fixed some formatting
Revision
721 -
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Modified
Tue Nov 8 13:32:27 2005 UTC
(19 years, 5 months ago)
by
chrisfen
File length: 19397 byte(s)
Diff to
previous 635
Added a keyword and ability to output forces and torques
Revision
601 -
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Modified
Thu Sep 15 19:17:04 2005 UTC
(19 years, 7 months ago)
by
tim
File length: 19198 byte(s)
Diff to
previous 507
Fix a bug in DumpReader in case readFrame is called without calling getNFrames
Revision
507 -
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Modified
Fri Apr 15 22:04:00 2005 UTC
(20 years ago)
by
gezelter
File length: 19150 byte(s)
Diff to
previous 417
xemacs has been drafted to perform our indentation services
Revision
274 -
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Modified
Tue Jan 25 21:59:18 2005 UTC
(20 years, 3 months ago)
by
tim
File length: 18893 byte(s)
Diff to
previous 273
fix a bug in SimInfo, use number of cutoff stamp as counter to loop over rigidbody stamp
Revision
273 -
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Modified
Tue Jan 25 17:45:23 2005 UTC
(20 years, 3 months ago)
by
tim
File length: 18330 byte(s)
Diff to
previous 246
(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
2 -
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Added
Fri Sep 24 04:16:43 2004 UTC
(20 years, 7 months ago)
by
gezelter
File length: 18157 byte(s)
Import of OOPSE v. 2.0