[ViewVC] Log of: group/trunk/SHAPES/GridBuilder.cpp

Revision 1285 - (view) (annotate) - [select for diffs]
Modified Tue Jun 22 18:04:58 2004 UTC (20 years, 10 months ago) by chrisfen
File length: 6238 byte(s)
Diff to previous 1283 , to selected 1280

Fixes to gridbuilder.  Now gives proper sigma, s, and epsilon values

Revision 1283 - (view) (annotate) - [select for diffs]
Modified Mon Jun 21 15:54:27 2004 UTC (20 years, 10 months ago) by gezelter
File length: 6226 byte(s)
Diff to previous 1282 , to selected 1280

a few bug fixes

Revision 1282 - (view) (annotate) - [select for diffs]
Modified Mon Jun 21 15:10:29 2004 UTC (20 years, 10 months ago) by chrisfen
File length: 6851 byte(s)
Diff to previous 1281 , to selected 1280

Fixed the grid builder rotation problems

Revision 1281 - (view) (annotate) - [select for diffs]
Modified Mon Jun 21 13:38:55 2004 UTC (20 years, 10 months ago) by chrisfen
File length: 7193 byte(s)
Diff to previous 1280

Now calculates energies and builds the grid files.  There are still bugs, but
it compiles and runs...

Revision 1280 - (view) (annotate) - [selected]
Modified Fri Jun 18 19:40:31 2004 UTC (20 years, 10 months ago) by chrisfen
File length: 3454 byte(s)
Diff to previous 1279

Fixed XCode auto-indent to match XEmacs

Revision 1279 - (view) (annotate) - [select for diffs]
Modified Fri Jun 18 19:01:40 2004 UTC (20 years, 10 months ago) by chrisfen
File length: 3236 byte(s)
Diff to previous 1278 , to selected 1280

Built principle axis determination and molecule rotation into calcRefCoords in RigidBody.cpp

Revision 1278 - (view) (annotate) - [select for diffs]
Modified Thu Jun 17 21:35:22 2004 UTC (20 years, 10 months ago) by chrisfen
File length: 3192 byte(s)
Diff to previous 1277 , to selected 1280

GridBuilder updates grid vectors

Revision 1277 - (view) (annotate) - [select for diffs]
Added Thu Jun 17 21:29:17 2004 UTC (20 years, 10 months ago) by chrisfen
File length: 3094 byte(s)
Diff to selected 1280

Added GridBuilder.cpp and .hpp.  Doesn't calculate energies yet...

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