Revision 1702 - (view) (annotate) - [select for diffs]
Modified Thu Apr 5 19:49:59 2012 UTC (13 years ago) by kstocke1
File length: 33649 byte(s)
Diff to previous 1701

Un-did some changes that weren't ready to be committed.

Added files for fcc and pentagonal nanorod builders. Updated runMe in samples/builders to include nanorod builders.

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: 33649 byte(s)
Diff to previous 1627

updated copyright notices

Splitting out ifstrstream into a header and an implementation.  This
means that much of the code that depends on it can be compiled only
once and the parallel I/O is concentrated into a few files.  To do
this, a number of files that relied on basic_ifstrstream to load the
mpi header had to be modified to manage their own headers.

Revision 1540 - (view) (annotate) - [select for diffs]
Modified Mon Jan 17 21:34:36 2011 UTC (14 years, 3 months ago) by gezelter
File length: 33672 byte(s)
Diff to previous 1465

changes for new parallel architecture

Creating busticated version of OpenMD

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/primitives/StuntDouble.hpp
File length: 33583 byte(s)
Diff to previous 1390

Adding property set to svn entries

Almost all of the changes necessary to create OpenMD out of our old
project (OOPSE-4)

Revision 1360 - (view) (annotate) - [select for diffs]
Modified Mon Sep 7 16:31:51 2009 UTC (15 years, 7 months ago) by cli2
Original Path: trunk/src/primitives/StuntDouble.hpp
File length: 33540 byte(s)
Diff to previous 1309

Added new restraint infrastructure
Added MolecularRestraints
Added ObjectRestraints
Added RestraintStamp
Updated thermodynamic integration to use ObjectRestraints
Added Quaternion mathematics for twist swing decompositions
Significantly updated RestWriter and RestReader to use dump-like files
Added selections for x, y, and z coordinates of atoms
Removed monolithic Restraints class
Fixed a few bugs in gradients of Euler angles in DirectionalAtom and RigidBody
Added some rotational capabilities to prinicpalAxisCalculator

many changes to keep track of particle potentials for both bonded and non-bonded interactions

Revision 1245 - (view) (annotate) - [select for diffs]
Modified Tue May 27 16:39:06 2008 UTC (16 years, 11 months ago) by chuckv
Original Path: trunk/src/primitives/StuntDouble.hpp
File length: 32405 byte(s)
Diff to previous 1112

Checking in changes for Hefland moment calculations

Changes to add thetacorr to dynamic props and fixes to radial rcorr.

Revision 1024 - (view) (annotate) - [select for diffs]
Modified Wed Aug 30 18:42:29 2006 UTC (18 years, 8 months ago) by tim
Original Path: trunk/src/primitives/StuntDouble.hpp
File length: 29359 byte(s)
Diff to previous 963

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.

Adding single precision capabilities to c++ side

Revision 945 - (view) (annotate) - [select for diffs]
Modified Tue Apr 25 02:09:01 2006 UTC (19 years ago) by gezelter
Original Path: trunk/src/primitives/StuntDouble.hpp
File length: 29098 byte(s)
Diff to previous 573

Adding spherical boundary conditions to LD integrator

putting spaceballs back where they belong

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/primitives/StuntDouble.hpp
File length: 28096 byte(s)
Diff to previous 334

xemacs has been drafted to perform our indentation services

begin bug 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/primitives/StuntDouble.hpp
File length: 30860 byte(s)
Diff to previous 205

merging new_design branch into OOPSE-2.0

isLinear and linearAxis are virtual in StuntDouble,
but are implemented by DirectionalAtom and RigidBody
In StuntDouble, they should return false and "-1" but
there should be logic to figure them out in the other
two classes

Revision 198 - (view) (annotate) - [select for diffs]
Modified Tue Nov 2 15:28:25 2004 UTC (20 years, 6 months ago) by chrisfen
Original Path: trunk/src/primitives/StuntDouble.hpp
File length: 2181 byte(s)
Diff to previous 132

Shapes looks like it's working

replace old GebericData with  new GenericData

Revision 3 - (view) (annotate) - [select for diffs]
Modified Fri Sep 24 16:27:58 2004 UTC (20 years, 7 months ago) by tim
Original Path: trunk/src/primitives/StuntDouble.hpp
File length: 2150 byte(s)
Diff to previous 2

change the #include in source files

Import of OOPSE v. 2.0