Revision 2955 - Directory Listing - [selected]
Modified Wed Jul 19 12:46:20 2006 UTC (17 years, 11 months ago) by chrisfen
Diff to previous 2777

Added tred to sample water.md files

Added TIP5P-E and fixed a bug for Thermodynamic integration (you can now have a lambda of 0)

Revision 2727 - Directory Listing - [select for diffs]
Modified Fri Apr 21 19:32:07 2006 UTC (18 years, 2 months ago) by chrisfen
Diff to previous 2489 , to selected 2955

Removed sqrt splines and shape stuff (doesn't work, so why was it in there?).  Changed some of the water samples to use shifted_force.  Probably should set the defaults to use the damped version now that we sped it up.

remove deprecated keywords from samples

Revision 2365 - Directory Listing - [select for diffs]
Modified Fri Oct 14 14:18:02 2005 UTC (18 years, 8 months ago) by chrisfen
Diff to previous 2326 , to selected 2955

added default restraint spring constants into Globals

fixing up some samples

Revision 2122 - Directory Listing - [select for diffs]
Modified Sat Mar 12 19:12:56 2005 UTC (19 years, 4 months ago) by chrisfen
Diff to previous 2121 , to selected 2955

forgot a couple of makefiles

added some samples