Greg Landrum
c3dc1fd914
These are mostly documentation changes. Exceptions are noted below.
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Wrap/MolChemicalFeature.cpp: expose ClearCache() method.
RDCode.sln: fix a dependency
2007-04-24 04:24:22 +00:00
Greg Landrum
0a80d8a9a2
support operator&=, operator|=, operator+=, and operator-= on UniformGrid3D objects (python and C++)
2007-03-24 14:55:29 +00:00
Greg Landrum
516132ba07
getStorage was declared but never defined
2007-03-19 05:28:39 +00:00
Greg Landrum
8272de5b99
reformatting
2007-03-16 06:06:39 +00:00
Greg Landrum
112ee00b59
this should teach me to be more careful when checking code in first thing in the morning
2007-01-30 17:49:43 +00:00
Greg Landrum
0eef292f4a
clean up a minor typing problem
2007-01-30 06:05:45 +00:00
Greg Landrum
8c668ffc17
add a protrusion distance metric
2007-01-30 05:20:23 +00:00
Greg Landrum
f31ac073b5
add pickle support to the UniformGrid and DiscreteValueVect classes;
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This still needs to be checked on linux
2007-01-26 04:41:36 +00:00
Greg Landrum
7a12b1b497
make Points pickle-able
2007-01-24 04:44:35 +00:00
Greg Landrum
cf728dbc7c
primarily project file changes to make things work
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with python 2.5
Also includes a slackening of the tolerance for a distgeomhelpers test.
2007-01-15 20:30:01 +00:00
Santosh Putta
08f9575e96
Adding a new virtual base class Point. Point2D, POint3D and a new PointND class all inherit from this class
2006-10-19 23:23:16 +00:00
Santosh Putta
3c1591f252
Adding a new virtual base class Point. Point2D, POint3D and a new PointND class all inherit from this class
2006-10-19 23:22:59 +00:00
Greg Landrum
a890611a22
merge back in changes from ChemTransforms (r30:51);
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the makefile for linux is still missing (I have one, I just need to retrieve it)
but otherwise this is in pretty good shape.
err, I think so at least.
2006-09-15 16:44:38 +00:00
Greg Landrum
8a19c38e21
- Get windows debug builds working
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- Remove requirement that boost be in $RDBASE/External on windows (the BOOSTHOME environment variable is now required)
- fix dependencies
This builds on windows in debug mode now and most tests pass. There's a problem with PySVD in debug mode and for some reason the rdAlignments wrapper test fails; but these don't seem super important.
https://sourceforge.net/tracker/index.php?func=detail&aid=1485703&group_id=160139&atid=814650
2006-05-11 00:42:39 +00:00
Greg Landrum
b87de75d56
get g++ out of the makefiles... use CXX instead
2006-05-09 23:20:26 +00:00
Greg Landrum
5d03333c22
setup svn keywords (should have done this before import... grn)
2006-05-06 22:54:39 +00:00
Greg Landrum
75a79b6327
initial import
2006-05-06 22:20:08 +00:00
