28 Commits

Author	SHA1	Message	Date
wdelano	95e899f0c9	props	2009-02-01 19:10:41 +00:00
wdelano	dc1d5b8b60	*** empty log message ***	2005-10-18 18:22:19 +00:00
wdelano	bc47a6f360	*** empty log message ***	2005-07-19 23:33:09 +00:00
wdelano	794032a156	*** empty log message ***	2004-11-12 21:36:15 +00:00
wdelano	4eed8f5cfd	*** empty log message ***	2004-11-01 04:23:10 +00:00
wdelano	27b6ba92b7	*** empty log message ***	2004-11-01 04:11:58 +00:00
wdelano	0876456aa0	*** empty log message ***	2004-11-01 02:36:26 +00:00
wdelano	991af5f9e0	*** empty log message ***	2004-10-05 04:54:55 +00:00
wdelano	82b607c109	*** empty log message ***	2004-10-05 02:14:52 +00:00
wdelano	b889f8cc39	*** empty log message ***	2004-02-09 20:45:52 +00:00
wdelano	b251ad2cfb	*** empty log message ***	2004-02-09 20:16:00 +00:00
wdelano	cc7c213ebb	*** empty log message ***	2003-09-27 05:07:59 +00:00
wdelano	511a749182	*** empty log message ***	2002-09-07 07:39:07 +00:00
wdelano	7ff0ed8d6e	*** empty log message ***	2001-12-08 18:43:40 +00:00
wdelano	e4d34b98a8	*** empty log message ***	2001-12-08 18:12:54 +00:00
wdelano	9de42d93f9	*** empty log message ***	2001-12-08 18:08:31 +00:00
wdelano	7201a201ed	*** empty log message ***	2001-04-21 02:54:13 +00:00
wdelano	a3e427c4f7	fixed	2001-03-20 08:52:15 +00:00
wdelano	9b64c95ca1	*** empty log message ***	2001-03-17 21:59:45 +00:00
wdelano	1139864f7c	new test cases, etc.	2001-03-17 20:59:05 +00:00
wdelano	b77aa9efe9	Pickled test structure	2001-03-17 07:01:34 +00:00
wdelano	95388c81a0	ChemPy fast models	2000-10-12 03:00:08 +00:00
wdelano	bfd090e383	again...	2000-09-17 01:11:14 +00:00
wdelano	bb1b31310e	Big stuff: labels representation and order of evaluation in selector.	2000-09-16 21:33:54 +00:00
wdelano	5d21a896c5	Fixed TIP3 water residue definition - compared with an old amber benchmark.	2000-09-16 04:03:07 +00:00
wdelano	6cb799a347	ACE and NME	2000-09-14 23:25:27 +00:00
wdelano	62924bb63e	Chempy/Tinker tests.	2000-09-13 03:05:39 +00:00
wdelano	4cc3ad944e	First step towards a test-suite infrastructure.	2000-09-12 09:48:30 +00:00