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e5d76df3bc222d4cd4e35f09a4cf442b6f4fe584
rdkit/Code/GraphMol/DistGeomHelpers
History
Greg Landrum 47d47a49d3 remove vestiges of old windows build system
2007-07-31 17:09:53 +00:00
..
test_data
fix a minor coordinate problem in the regressions (connected to new chirality handling)
2006-11-22 04:25:24 +00:00
Wrap
remove vestiges of old windows build system
2007-07-31 17:09:53 +00:00
BoundsMatrixBuilder.cpp
setup svn keywords (should have done this before import... grn)
2006-05-06 22:54:39 +00:00
BoundsMatrixBuilder.h
initial import
2006-05-06 22:20:08 +00:00
Embedder.cpp
Embedder: reformatting
2007-07-09 05:31:32 +00:00
Embedder.h
Embedder: reformatting
2007-07-09 05:31:32 +00:00
Makefile
adding option argument pruneRmsThresh to EmbedMultipleConfs to prune away similar conformations
2006-10-02 23:17:04 +00:00
test_list.py
initial import
2006-05-06 22:20:08 +00:00
testDgeomHelpers.cpp
fix a minor coordinate problem in the regressions (connected to new chirality handling)
2006-11-22 04:25:24 +00:00
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