Greg Landrum a890611a22 merge back in changes from ChemTransforms (r30:51); ...

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

..

AtomPairs

setup svn keywords (should have done this before import... grn)

2006-05-06 22:54:39 +00:00

ChemUtils

merge back in changes from ChemTransforms (r30:51);

2006-09-15 16:44:38 +00:00

Draw

sync with main RD repository; r5201

2006-05-23 00:10:37 +00:00

EState

setup svn keywords (should have done this before import... grn)

2006-05-06 22:54:39 +00:00

FeatMaps

Add initial pass at merge functionality

2006-08-31 04:10:00 +00:00

Features

merge back in changes from ChemTransforms (r30:51);

2006-09-15 16:44:38 +00:00

Fingerprints

setup svn keywords (should have done this before import... grn)

2006-05-06 22:54:39 +00:00

Pharm2D

setup svn keywords (should have done this before import... grn)

2006-05-06 22:54:39 +00:00

Pharm3D

setup svn keywords (should have done this before import... grn)

2006-05-06 22:54:39 +00:00

Suppliers

setup svn keywords (should have done this before import... grn)

2006-05-06 22:54:39 +00:00

tests

initial import

2006-05-06 22:20:08 +00:00

__init__.py

setup svn keywords (should have done this before import... grn)

2006-05-06 22:54:39 +00:00

AllChem.py

setup svn keywords (should have done this before import... grn)

2006-05-06 22:54:39 +00:00

AvailDescriptors.py

setup svn keywords (should have done this before import... grn)

2006-05-06 22:54:39 +00:00

BuildFragmentCatalog.py

setup svn keywords (should have done this before import... grn)

2006-05-06 22:54:39 +00:00

CDXMLWriter.py

setup svn keywords (should have done this before import... grn)

2006-05-06 22:54:39 +00:00

ChemicalFeatures.py

setup svn keywords (should have done this before import... grn)

2006-05-06 22:54:39 +00:00

ChemicalForceFields.py

setup svn keywords (should have done this before import... grn)

2006-05-06 22:54:39 +00:00

Crippen.py

setup svn keywords (should have done this before import... grn)

2006-05-06 22:54:39 +00:00

Descriptors.py

setup svn keywords (should have done this before import... grn)

2006-05-06 22:54:39 +00:00

DSViewer.py

setup svn keywords (should have done this before import... grn)

2006-05-06 22:54:39 +00:00

FeatFinderCLI.py

setup svn keywords (should have done this before import... grn)

2006-05-06 22:54:39 +00:00

FragmentCatalog.py

setup svn keywords (should have done this before import... grn)

2006-05-06 22:54:39 +00:00

FragmentMatcher.py

setup svn keywords (should have done this before import... grn)

2006-05-06 22:54:39 +00:00

Fragments.py

setup svn keywords (should have done this before import... grn)

2006-05-06 22:54:39 +00:00

GraphDescriptors.py

setup svn keywords (should have done this before import... grn)

2006-05-06 22:54:39 +00:00

Graphs.py

setup svn keywords (should have done this before import... grn)

2006-05-06 22:54:39 +00:00

Lipinski.py

setup svn keywords (should have done this before import... grn)

2006-05-06 22:54:39 +00:00

MACCSkeys.py

setup svn keywords (should have done this before import... grn)

2006-05-06 22:54:39 +00:00

MolSurf.py

setup svn keywords (should have done this before import... grn)

2006-05-06 22:54:39 +00:00

PeriodicTable.py

setup svn keywords (should have done this before import... grn)

2006-05-06 22:54:39 +00:00

Polymers.py

setup svn keywords (should have done this before import... grn)

2006-05-06 22:54:39 +00:00

PyMol.py

setup svn keywords (should have done this before import... grn)

2006-05-06 22:54:39 +00:00

Randomize.py

setup svn keywords (should have done this before import... grn)

2006-05-06 22:54:39 +00:00

SATIS.py

setup svn keywords (should have done this before import... grn)

2006-05-06 22:54:39 +00:00

ShowMols.py

setup svn keywords (should have done this before import... grn)

2006-05-06 22:54:39 +00:00

TemplateAlign.py

setup svn keywords (should have done this before import... grn)

2006-05-06 22:54:39 +00:00

test_list.py

initial import

2006-05-06 22:20:08 +00:00

UnitTestArom.py

setup svn keywords (should have done this before import... grn)

2006-05-06 22:54:39 +00:00

UnitTestCatalog.py

setup svn keywords (should have done this before import... grn)

2006-05-06 22:54:39 +00:00

UnitTestChem.py

setup svn keywords (should have done this before import... grn)

2006-05-06 22:54:39 +00:00

UnitTestChemAtom.py

setup svn keywords (should have done this before import... grn)

2006-05-06 22:54:39 +00:00

UnitTestChemBond.py

setup svn keywords (should have done this before import... grn)

2006-05-06 22:54:39 +00:00

UnitTestChemSmarts.py

setup svn keywords (should have done this before import... grn)

2006-05-06 22:54:39 +00:00

UnitTestChemv2.py

setup svn keywords (should have done this before import... grn)

2006-05-06 22:54:39 +00:00

UnitTestCrippen.py

setup svn keywords (should have done this before import... grn)

2006-05-06 22:54:39 +00:00

UnitTestFragmentDescriptors.py

setup svn keywords (should have done this before import... grn)

2006-05-06 22:54:39 +00:00

UnitTestFragments.py

setup svn keywords (should have done this before import... grn)

2006-05-06 22:54:39 +00:00

UnitTestGraphDescriptors.2.py

setup svn keywords (should have done this before import... grn)

2006-05-06 22:54:39 +00:00

UnitTestLipinski.py

setup svn keywords (should have done this before import... grn)

2006-05-06 22:54:39 +00:00

UnitTestOldBugs.py

setup svn keywords (should have done this before import... grn)

2006-05-06 22:54:39 +00:00

UnitTestSATIS.py

setup svn keywords (should have done this before import... grn)

2006-05-06 22:54:39 +00:00

UnitTestSmiles.py

setup svn keywords (should have done this before import... grn)

2006-05-06 22:54:39 +00:00

UnitTestSubgraphs.py

setup svn keywords (should have done this before import... grn)

2006-05-06 22:54:39 +00:00

UnitTestSuppliers.py

setup svn keywords (should have done this before import... grn)

2006-05-06 22:54:39 +00:00

UnitTestSurf.py

setup svn keywords (should have done this before import... grn)

2006-05-06 22:54:39 +00:00