Revision 1283 - Directory Listing - [select for diffs]
Modified Mon Jun 21 15:54:27 2004 UTC (21 years, 1 month ago) by gezelter
Diff to previous 1282

a few bug fixes

Fixed the grid builder rotation problems

Revision 1281 - Directory Listing - [select for diffs]
Modified Mon Jun 21 13:38:55 2004 UTC (21 years, 1 month ago) by chrisfen
Diff to previous 1280

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

Fixed XCode auto-indent to match XEmacs

Revision 1279 - Directory Listing - [select for diffs]
Modified Fri Jun 18 19:01:40 2004 UTC (21 years, 1 month ago) by chrisfen
Diff to previous 1278

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

GridBuilder updates grid vectors

Revision 1277 - Directory Listing - [select for diffs]
Modified Thu Jun 17 21:29:17 2004 UTC (21 years, 1 month ago) by chrisfen
Diff to previous 1276

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

Cleaned up unused variables.  Added findMaxExtent to RigidBody.cpp

Revision 1275 - Directory Listing - [select for diffs]
Modified Tue Jun 15 22:36:23 2004 UTC (21 years, 1 month ago) by chrisfen
Diff to previous 1274

Added a bandwidth command-line option

bug fix on vdw files

Revision 1273 - Directory Listing - [select for diffs]
Modified Tue Jun 15 20:24:51 2004 UTC (21 years, 1 month ago) by gezelter
Diff to previous 1272

fixed a subdirs bug

configure isn't really necessary

Revision 1271 - Directory Listing - [select for diffs]
Modified Tue Jun 15 20:20:36 2004 UTC (21 years, 1 month ago) by gezelter
Diff to previous 1247

Major changes for rigidbodies

Fixes

Revision 1244 - Directory Listing - [select for diffs]
Modified Fri Jun 4 16:21:23 2004 UTC (21 years, 1 month ago) by gezelter
Diff to previous 1243

Migrated vdw files from OOPSE

fixing for a separate existence

Revision 1242 - Directory Listing - [select for diffs]
Modified Fri Jun 4 16:13:45 2004 UTC (21 years, 1 month ago) by gezelter
Diff to previous 1240

forcer was a binary

Initial import of SHAPES code